Mercurial > repos > jjohnson > peptideshaker

comparison test-data/searchgui_tinyspectra1.mgf @ 0:8b99cb00e1c4 draft

Find changesets by keywords (author, files, the commit message), revision number or hash, or revset expression.
planemo upload for repository https://github.com/galaxyproteomics/tools-galaxyp/tree/master/tools/peptideshaker commit 3c83b8f8ca60d6399bc5dd7096b830ca1f1c457e-dirty
author jjohnson
date Tue, 15 May 2018 14:50:35 -0400
parents
children
comparison
equal deleted inserted replaced
-1:000000000000 0:8b99cb00e1c4
1 BEGIN IONS
2 TITLE= Cmpd 636, +MSn(730.3981), 66.9 min
3 PEPMASS=730.39814 92569
4 CHARGE=2+
5 156.06738 122
6 175.10440 1049
7 186.08322 120
8 187.12501 241
9 188.06515 494 1+
10 193.09503 180
11 197.12522 208
12 199.17309 1374 1+
13 204.08687 454 1+
14 213.14347 128
15 215.11998 747 1+
16 227.17167 1524 1+
17 229.12416 156
18 233.09327 3574 1+
19 236.99586 113
20 243.14264 571 1+
21 244.07481 236
22 245.12901 240
23 246.12647 275
24 256.20038 432 1+
25 258.12496 133
26 260.19976 423
27 261.09190 17853 1+
28 270.16206 114
29 274.12614 207
30 283.15366 136
31 284.18559 406 1+
32 286.14626 237
33 287.10013 105
34 301.15759 131
35 303.17924 2962 1+
36 310.21264 944 1+
37 315.13250 122
38 316.16696 108
39 326.16601 145
40 328.21268 874 1+
41 335.13393 406 1+
42 338.20704 186
43 339.16449 110
44 342.17857 106
45 344.13585 148
46 346.17426 809 1+
47 356.21762 685 1+
48 358.15839 265
49 359.26213 106
50 362.14671 528 1+
51 366.16564 103
52 370.14930 136
53 374.17893 18824 1+
54 380.20460 141
55 384.22488 193
56 387.21562 161
57 388.26191 188
58 411.26204 166
59 415.22868 119
60 416.26432 2092 1+
61 421.21633 119
62 423.29102 378 1+
63 425.19591 120
64 429.24479 213
65 430.23711 292
66 431.20421 187
67 436.18404 103
68 436.75217 164
69 437.24576 210
70 439.24189 686 1+
71 441.27348 282
72 442.22757 266
73 443.24151 187
74 447.25851 136
75 448.23776 110
76 451.24187 133
77 454.21183 186
78 455.28038 426 1+
79 457.22899 1666 1+
80 459.26367 3533 1+
81 470.24566 153
82 471.25916 214
83 472.22369 149
84 475.22776 2402 1+
85 476.74146 108
86 478.76406 148
87 479.26444 182
88 481.79718 109
89 482.23965 265
90 484.28349 122
91 485.26864 194
92 487.26385 8530 1+
93 487.76699 2322 2+
94 492.79121 214
95 493.27987 223
96 496.25943 155
97 498.26458 113
98 499.26123 188
99 500.25926 116
100 502.31880 144
101 503.29803 113
102 505.25694 134
103 507.23129 148
104 509.26114 112
105 512.29082 270
106 516.25599 158
107 517.20915 133
108 517.28047 196
109 518.26358 209
110 519.25298 141
111 524.32901 134
112 525.28341 246
113 525.73648 129
114 526.28178 183
115 527.27825 442 1+
116 530.27675 144
117 531.28549 121
118 533.28116 104
119 534.11078 105
120 534.80853 658 2+
121 536.27223 192
122 537.26164 134
123 538.59905 107
124 539.27286 106
125 540.27423 189
126 541.25963 119
127 542.30271 822 1+
128 543.81900 3982 2+
129 544.31230 3061 1+
130 546.73644 112
131 550.76990 117
132 551.22357 107
133 552.32208 662 1+
134 555.31596 235
135 556.27474 176
136 558.29453 154
137 559.29947 142
138 560.30729 1143 1+
139 567.24429 116
140 569.25892 228
141 570.29732 7469 1+
142 575.31645 290
143 580.32039 169
144 584.32568 221
145 585.29844 155
146 588.30437 6069 1+
147 591.34398 1900 2+
148 593.19489 103
149 594.32473 103
150 598.30327 171
151 600.36464 3642 2+
152 602.30487 970 1+
153 608.28169 160
154 609.27493 133
155 614.83731 112
156 615.27771 193
157 617.30438 138
158 618.32896 149
159 619.33485 160
160 620.31542 115
161 620.81406 230
162 622.32210 208
163 623.32017 135
164 624.28638 129
165 626.34792 207
166 628.34041 189
167 629.25299 114
168 630.37407 171
169 632.31114 124
170 634.29651 120
171 636.28359 105
172 637.35608 222
173 638.34750 245
174 639.34410 173
175 641.33612 839 1+
176 646.33654 117
177 647.19559 1433 1+
178 649.19722 1100 1+
179 651.31229 136
180 653.31813 227
181 654.33373 187
182 655.38010 176
183 656.35127 649 1+
184 658.36493 6652 1+
185 664.87410 264
186 665.36702 578 1+
187 668.36277 108
188 669.88900 118
189 671.36838 605 1+
190 673.38354 533 1+
191 674.31604 138
192 680.33315 119
193 682.86635 152
194 683.37863 4557 1+
195 689.35741 806 1+
196 693.34598 140
197 695.38537 116
198 696.37550 112
199 697.39934 146
200 698.39359 132
201 699.36352 115
202 701.38282 1437 1+
203 706.39934 164
204 707.37693 151
205 707.86433 178
206 710.37380 213
207 712.37982 250
208 712.89070 251
209 713.37280 260
210 713.88658 123
211 715.37058 153
212 716.18442 4201 1+
213 716.77672 108
214 718.18321 2451 1+
215 718.88287 2231 2+
216 720.98962 121
217 721.39031 3707 2+
218 724.88574 175
219 725.39311 174
220 725.86419 119
221 726.38179 168
222 726.88029 279
223 727.39635 1151 2+
224 729.38218 580
225 729.89636 3472 1+
226 730.39870 7202 2+
227 733.22310 218
228 733.30736 209
229 733.86699 2221 2+
230 734.87807 2000 2+
231 737.41263 157
232 738.38323 548 1+
233 741.39676 215
234 742.38824 893 1+
235 748.42865 106
236 757.40883 110
237 759.41390 16956 1+
238 766.39835 135
239 768.40610 123
240 773.41497 135
241 775.43074 138
242 779.38031 110
243 784.42558 899 1+
244 787.90750 114
245 788.43303 156
246 802.43422 958 1+
247 818.92372 110
248 819.43952 106
249 830.50628 147
250 838.45103 121
251 855.49252 207
252 866.39951 113
253 872.50085 6571 1+
254 880.44367 148
255 886.46997 133
256 891.44688 208
257 899.47954 151
258 912.47926 133
259 914.49331 112
260 916.46838 134
261 924.48363 139
262 926.42073 111
263 955.52131 165
264 956.52827 785 1+
265 973.55087 13950 1+
266 978.51217 225
267 979.51564 116
268 980.49756 186
269 1008.48933 103
270 1044.54839 219
271 1068.60979 255 1+
272 1086.63071 4224 1+
273 1187.60270 135
274 1199.72200 1064 1+
275 END IONS
276
277 BEGIN IONS
278 TITLE= Cmpd 67, +MSn(562.2947), 26.3 min
279 PEPMASS=562.29468 458049
280 CHARGE=2+
281 173.10446 888
282 175.10614 7500 1+
283 179.03885 2115 1+
284 181.05013 1444
285 185.10363 748
286 188.09581 546
287 189.08230 1123
288 191.10888 1205
289 193.08988 20362 1+
290 197.12012 1004
291 198.08421 1715
292 199.08156 3683 1+
293 201.11270 1482
294 202.08307 5961 1+
295 204.12828 1144
296 207.10914 5879 1+
297 212.09747 547
298 214.14801 786
299 215.13458 1085
300 216.09374 15154 1+
301 219.10360 3767 1+
302 221.09583 10438 1+
303 225.12049 686
304 227.09977 1455
305 229.09603 679
306 230.09470 604
307 234.13140 812
308 235.10913 3141 1+
309 240.12624 583
310 242.14853 1597
311 243.13141 1136
312 243.63267 1229 2+
313 246.14582 824
314 247.10615 2963 1+
315 249.12485 2272 1+
316 251.09894 784
317 258.11066 836
318 260.12524 538
319 262.12141 584
320 263.11268 636
321 265.12053 103781 1+
322 271.17377 1450
323 272.15453 573
324 274.12336 539
325 275.11834 708
326 276.09317 1249
327 277.14342 854
328 280.13885 636
329 284.15463 954
330 287.13794 562
331 288.18831 7132 2+
332 289.19895 1160
333 290.11827 4566 1+
334 292.12562 712
335 293.11785 69474 1+
336 300.14093 627
337 304.16113 1144
338 306.14825 620
339 308.12685 9469 1+
340 308.69190 3688 2+
341 311.16807 1795
342 312.16397 1139
343 314.10629 664
344 318.14640 1024
345 321.66995 1635
346 327.13385 5132 1+
347 329.18522 5655 1+
348 330.67072 637
349 332.18505 1032
350 333.18476 663
351 335.13067 608
352 336.15792 840
353 339.67673 1005 2+
354 344.15007 889
355 345.15213 4010 1+
356 351.18768 4419 1+
357 355.13808 828
358 356.17043 621
359 357.18025 719
360 358.16658 563
361 361.17543 1147
362 362.15427 4190 1+
363 363.72203 3811
364 364.20914 3218 2+
365 371.19073 760
366 372.72285 2668 2+
367 375.19700 3108 2+
368 376.19553 564
369 379.17827 2873 2+
370 380.15890 12301 1+
371 384.21017 5097 2+
372 388.19333 571
373 389.70908 625
374 390.20740 592
375 391.19383 935
376 392.16591 729
377 395.20382 1623
378 397.17996 3655 2+
379 398.21650 6989 2+
380 404.20531 1679
381 405.20451 648
382 406.20004 871
383 407.23483 3907
384 407.72953 7744 2+
385 409.19414 3554 1+
386 412.21632 855
387 413.21323 2691 2+
388 415.20292 594
389 416.24330 17092 2+
390 418.22634 576
391 419.20423 1028
392 421.20851 587
393 422.21092 764
394 423.20934 713
395 427.20492 813
396 428.16738 688
397 429.70811 698
398 430.23256 912
399 431.73361 1035
400 432.22171 968
401 433.22466 1062
402 434.22575 625
403 437.19018 1766
404 437.70624 844
405 438.20626 708
406 438.72150 4563 2+
407 440.22185 3932 1+
408 444.21463 1090
409 445.20585 995
410 446.18388 773
411 447.22090 850
412 447.72488 15238 2+
413 451.22638 610
414 452.25000 1142
415 453.24346 537
416 453.74918 661
417 454.23077 5371 2+
418 456.23340 746
419 456.72936 1991 2+
420 458.22230 3870 1+
421 461.16717 1481
422 462.21058 1210
423 462.75299 32114 2+
424 467.23212 705
425 468.23541 868
426 469.23311 912
427 471.75085 2992 2+
428 473.18561 1671
429 474.18911 847
430 475.25224 1171
431 476.24847 7765 2+
432 477.24608 1292
433 480.22910 1603
434 480.76227 2464 2+
435 482.23306 595
436 484.20956 682
437 485.27210 936
438 485.75948 6878 2+
439 486.25807 6262 1+
440 490.20675 12478 1+
441 495.23849 541
442 496.24307 922
443 498.23260 594
444 500.23943 811
445 500.74355 799
446 501.24660 1342
447 501.75096 767
448 502.23819 884
449 502.75774 1142
450 503.29629 97816 1+
451 506.77634 937
452 508.21508 7010 1+
453 510.25588 4848 1+
454 513.25831 729
455 514.27402 607
456 515.27095 609
457 516.28189 537
458 517.25442 1057
459 518.25007 538
460 519.24078 613
461 520.24934 791
462 521.25847 869
463 522.26590 547
464 525.25538 703
465 526.26034 1210
466 527.29422 8151 1+
467 533.26970 1046
468 534.26291 800
469 535.27080 1196
470 535.77587 1190
471 536.26276 1367
472 536.76878 648
473 537.25293 646
474 538.25073 1260
475 539.28017 612
476 539.77084 658
477 540.26114 696
478 541.27313 648
479 543.27369 589
480 544.28397 3621
481 544.77706 12851 2+
482 547.31924 1572
483 548.30436 1053
484 548.77028 1441
485 549.26783 974
486 551.27120 606
487 553.28974 18838 2+
488 556.24380 1017
489 557.27702 1007
490 557.77103 8323 2+
491 559.28097 1288
492 559.78464 926
493 560.29805 5478 1+
494 561.29757 15114 1+
495 561.81158 1177
496 562.29457 15730 2+
497 564.83168 892
498 565.33570 23486 1+
499 565.82267 7693 2+
500 569.28499 554
501 573.26338 1027
502 575.36935 2237 1+
503 577.29711 19918 1+
504 585.28764 707
505 586.26526 885
506 593.29456 4026 1+
507 597.28990 684
508 598.35983 1347
509 599.34599 3235 1+
510 603.27890 4807 1+
511 609.33013 725
512 609.83310 554
513 616.37652 80669 1+
514 621.30217 7218 1+
515 626.35600 739
516 630.34615 639
517 631.28837 656
518 634.31334 979
519 638.82604 771
520 639.30650 830
521 640.32500 648
522 641.37035 821
523 642.32980 1346
524 643.32755 574
525 647.30833 1395
526 648.30970 855
527 657.35993 790
528 658.31601 805
529 659.31744 547
530 660.32673 1395
531 661.32915 982
532 663.32964 646
533 664.29941 618
534 678.34617 30703 1+
535 688.32596 637
536 690.31904 640
537 691.32139 4076 1+
538 698.38384 5422 1+
539 723.87438 588
540 724.36414 728
541 726.40991 944
542 727.41101 8337 1+
543 744.43842 30248 1+
544 749.38673 1066 1+
545 752.39235 798
546 757.34926 1237 1+
547 769.38486 632
548 776.45851 4801 1+
549 780.37732 723
550 781.36751 595
551 784.43240 550
552 793.35265 293 1+
553 795.42573 1882 1+
554 807.40774 1432
555 813.46325 3193
556 814.45178 9778 1+
557 825.41918 13786 1+
558 831.47933 145010 1+
559 876.43573 1256 1+
560 880.45054 717
561 894.44249 2606 1+
562 906.45477 635
563 912.45145 16141 1+
564 924.49870 3138 1+
565 934.46152 1295
566 935.45377 568
567 942.49443 7444 1+
568 951.48967 455 1+
569 960.51726 19263 1+
570 970.51168 1274 1+
571 END IONS
572
573 BEGIN IONS
574 TITLE= Cmpd 357, +MSn(687.8723), 46.6 min
575 PEPMASS=687.87224 60013
576 CHARGE=2+
577 159.07712 143
578 173.11274 328 1+
579 175.08239 118
580 186.07972 534 1+
581 188.13001 187
582 189.05530 214
583 197.09078 133
584 201.11035 396
585 203.10057 87
586 204.08084 813 1+
587 212.10341 163
588 214.11364 453 1+
589 216.09422 361 1+
590 219.13688 276
591 221.09569 97
592 223.13444 124
593 226.15032 242
594 227.14922 321 1+
595 229.12698 152
596 230.13134 466 1+
597 234.12847 513 1+
598 237.12577 143
599 242.15397 115
600 244.14098 325 1+
601 248.15828 1590 1+
602 252.12291 100
603 254.14965 2674 1+
604 257.12863 243
605 258.13708 885 1+
606 260.11136 961 1+
607 262.12249 257
608 265.10907 128
609 268.13765 90
610 269.14000 127
611 271.16588 160
612 272.15509 485 1+
613 274.12776 170
614 278.14834 117
615 283.16864 148
616 284.17008 352 1+
617 286.14005 764 1+
618 290.10832 146
619 292.15305 670 1+
620 299.18164 314 1+
621 301.18704 494
622 302.14660 965 1+
623 304.19314 118
624 310.17475 508
625 311.17809 710 1+
626 313.18489 598 1+
627 316.18398 90
628 319.20018 2167 1+
629 325.19827 154
630 326.15791 121
631 327.19143 356 1+
632 329.17898 5064 1+
633 332.14134 119
634 334.17531 168
635 337.20095 119
636 339.17861 109
637 341.16356 84
638 342.18333 125
639 343.18222 685 1+
640 347.14665 375 1+
641 350.18543 94
642 351.20109 188
643 354.15974 193
644 355.20020 723 1+
645 356.16702 110
646 358.18315 142
647 359.15776 87
648 361.19018 174
649 362.19594 92
650 365.18275 92
651 366.20984 1050 1+
652 371.18549 924 1+
653 373.18488 1189 1+
654 381.18868 149
655 382.20672 500 1+
656 384.22447 4352 1+
657 389.19110 810 1+
658 396.20689 150
659 397.19316 151
660 398.20703 86
661 399.20408 300
662 400.20486 1348 1+
663 405.05866 86
664 407.19164 147
665 411.19830 139
666 412.23136 96
667 413.20505 197
668 413.72608 629 2+
669 415.20808 936 1+
670 418.18360 623 1+
671 418.73432 85
672 421.27891 109
673 423.24460 118
674 424.21825 181
675 425.19357 929 2+
676 426.22584 718 1+
677 428.16497 98
678 429.20700 139
679 430.21241 148
680 432.23977 1912 1+
681 432.70426 113
682 435.16542 116
683 437.24338 220
684 438.24396 695 1+
685 442.21517 5079 1+
686 449.22684 128
687 452.26279 302
688 453.25158 780 1+
689 455.25717 1673 1+
690 458.25122 607 1+
691 458.75977 122
692 459.20225 133
693 460.22560 3821 1+
694 465.22199 126
695 467.19249 116
696 467.69022 104
697 468.22584 236
698 469.23849 616 1+
699 471.24869 1534 1+
700 472.72922 91
701 476.25294 132
702 477.22816 107
703 478.26141 110
704 481.23922 89
705 482.25547 156
706 483.24014 420 1+
707 485.25837 518
708 486.24040 1937 1+
709 487.77904 106
710 489.28812 1536 1+
711 492.17038 129
712 493.24044 157
713 494.17521 88
714 494.72931 105
715 495.23500 179
716 496.24497 1697 1+
717 498.69601 114
718 501.25727 446 1+
719 503.26610 1793 1+
720 508.25467 96
721 509.26839 410 1+
722 511.22931 103
723 512.22916 114
724 513.25101 5355 1+
725 516.74613 134
726 518.25568 146
727 522.33235 85
728 523.78777 1255 2+
729 526.28276 1713 1+
730 528.76842 89
731 531.26272 3775 1+
732 534.26598 299 1+
733 536.29380 88
734 537.30548 115
735 538.26228 105
736 539.28718 160
737 540.28525 106
738 541.25159 188
739 542.25405 199
740 543.26926 538 1+
741 546.32372 6048 1+
742 552.30262 1325 2+
743 554.29979 180
744 555.29537 491 1+
745 556.75583 89
746 557.27569 1600 1+
747 565.33244 201
748 566.27686 739 1+
749 569.31315 221
750 570.29380 1037 1+
751 574.30160 1230 1+
752 579.29804 109
753 580.26840 88
754 582.29318 350 1+
755 584.29153 2462 1+
756 588.29552 579 1+
757 591.28940 119
758 592.30999 86
759 593.28815 129
760 594.34334 91
761 596.30007 120
762 597.31800 545 1+
763 599.34708 244
764 599.82855 221
765 600.31882 787 1+
766 602.30198 3671 1+
767 607.25947 92
768 608.28874 270
769 608.84253 4210 2+
770 611.29432 86
771 613.30246 174
772 614.27396 171
773 615.31040 540 1+
774 617.36439 10010 1+
775 623.27915 153
776 625.32506 133
777 626.33386 100
778 627.34250 629 1+
779 630.32262 121
780 631.32454 158
781 632.29695 128
782 633.30423 137
783 636.27276 96
784 637.36953 110
785 640.29654 111
786 641.32021 1293 1+
787 643.86735 89
788 645.37440 91
789 648.29977 123
790 650.35518 106
791 651.32891 85
792 652.35458 940 1+
793 652.86264 105
794 656.31592 131
795 657.34403 152
796 659.32410 1619 1+
797 663.84817 211
798 664.35002 100
799 665.30702 94
800 666.31878 118
801 667.29416 120
802 668.35173 144
803 669.34227 326
804 669.86189 1202 2+
805 670.36281 1087 1+
806 675.36496 117
807 678.26899 361
808 678.86963 1917 2+
809 681.34054 544 1+
810 684.80492 113
811 685.21637 488 1+
812 685.40059 139
813 685.84558 146
814 686.32663 149
815 686.39633 102
816 686.82498 144
817 687.33233 320
818 687.88003 6158 2+
819 688.37787 4258 1+
820 690.85474 649 1+
821 693.35177 127
822 693.89424 944 2+
823 696.32463 88
824 698.36884 619 1+
825 708.36862 92
826 710.32848 93
827 713.37961 281 1+
828 715.37507 219
829 716.43486 3094 1+
830 720.40736 98
831 722.38310 111
832 723.36363 130
833 727.38319 88
834 728.35669 128
835 729.36284 106
836 730.38402 545 1+
837 736.34162 169
838 737.37261 102
839 739.34029 91
840 740.38762 1015 1+
841 754.38955 95
842 755.41186 119
843 756.46262 96
844 758.39194 1457 1+
845 772.42914 97
846 773.45385 14483 1+
847 779.35786 126
848 785.38783 136
849 806.39722 153
850 807.41952 111
851 811.41762 167
852 824.39268 88
853 826.44488 1375 1+
854 829.43557 829 1+
855 836.42980 94
856 839.40630 89
857 841.41635 85
858 844.49258 10033 1+
859 849.37985 198 1+
860 852.41452 156
861 853.45212 116
862 854.42252 118
863 860.41055 117
864 866.43590 100
865 867.39988 168
866 868.42669 103
867 868.90958 97
868 869.44607 98
869 880.43658 238
870 882.40883 91
871 886.47167 94
872 887.48393 103
873 898.46998 132
874 903.50727 124
875 915.52858 8321 1+
876 943.43875 88
877 979.51170 101
878 1046.56827 1394 1+
879 1056.57333 97
880 1103.59797 2225 1+
881 END IONS
882
883 BEGIN IONS
884 TITLE= Cmpd 1197, +MSn(759.6966), 115.6 min
885 PEPMASS=759.69661 105750
886 CHARGE=3+
887 186.10412 112
888 200.12978 116
889 201.11508 199
890 215.12847 573 1+
891 217.13204 178
892 218.14654 3471 1+
893 225.11230 155
894 229.12411 161
895 230.08661 111
896 231.09629 210
897 232.10636 155
898 234.12088 145
899 241.08227 343
900 242.13690 1947 1+
901 243.13494 997 2+
902 251.14776 886 1+
903 259.09362 2528 1+
904 289.16151 160
905 309.99744 123
906 315.16776 538 1+
907 318.13360 115
908 330.12151 122
909 332.15995 208
910 333.18107 10471 1+
911 350.21552 580
912 353.17657 967 1+
913 354.68081 132
914 357.24899 1554 1+
915 360.15877 206
916 370.19803 168
917 371.19182 511
918 372.18200 2231 1+
919 385.21525 152
920 389.22620 227
921 390.24212 146
922 404.69264 1057 2+
923 409.70252 597
924 410.20039 878 2+
925 413.22020 117
926 413.69567 1540 2+
927 418.70906 4084 2+
928 423.21488 122
929 424.05212 110
930 424.19180 122
931 440.72768 157
932 441.22664 670 2+
933 443.22132 109
934 446.21890 586 1+
935 456.22055 927 2+
936 458.23166 122
937 459.24831 160
938 461.20831 676 1+
939 464.22185 18608 1+
940 464.74963 110
941 465.72418 2987 2+
942 469.21096 110
943 470.21269 4776 2+
944 473.26107 117
945 475.25001 4621 2+
946 479.21897 4692 2+
947 481.29167 123
948 482.22796 812 1+
949 485.26260 893 1+
950 491.20823 168
951 492.20057 110
952 499.29634 155
953 499.79554 221
954 500.24981 1336 1+
955 500.76712 249
956 503.22512 563 1+
957 506.26448 205
958 506.78011 164
959 512.25439 134
960 515.26526 175
961 515.76685 111
962 517.28144 110
963 521.28257 151
964 521.76398 1499 2+
965 526.75707 397 1+
966 530.77244 233
967 531.26694 226
968 531.75749 167
969 532.25080 174
970 534.79631 346
971 535.30847 276
972 535.76053 12200 2+
973 539.77245 2914 2+
974 542.26539 148
975 543.29634 233
976 543.74664 200
977 544.31068 109
978 547.28849 138
979 547.80508 114
980 550.29467 178
981 553.24588 128
982 555.76691 119
983 556.24813 123
984 557.29591 562 2+
985 559.31861 423 1+
986 562.24799 169
987 563.14696 119
988 569.29669 137
989 570.30659 1029 1+
990 575.79283 130
991 576.78453 124
992 577.30336 11408 1+
993 577.79249 163
994 580.81267 244
995 581.79033 156
996 582.31042 204
997 583.34087 114
998 586.28784 1458 2+
999 588.26712 165
1000 589.28836 141
1001 590.25776 415
1002 591.27412 1194 1+
1003 591.77799 665 2+
1004 595.28672 2218 2+
1005 597.29583 526 1+
1006 599.27820 372
1007 599.79027 341
1008 600.27957 13399 2+
1009 603.27890 192
1010 604.29543 5129 2+
1011 608.25800 688 2+
1012 610.30049 969 1+
1013 613.29804 1340 1+
1014 619.26067 570 1+
1015 622.30408 183
1016 622.83703 127
1017 623.33929 120
1018 623.82737 146
1019 624.31328 175
1020 626.81953 140
1021 628.31983 119
1022 629.34750 154
1023 629.80178 121
1024 630.78463 117
1025 631.31006 147
1026 632.32766 137
1027 632.87475 195
1028 633.33833 185
1029 634.80740 161
1030 635.32186 224
1031 637.82473 191
1032 638.32260 176
1033 641.85570 230
1034 642.29647 189
1035 642.80444 164
1036 643.30102 124
1037 644.33123 249
1038 644.82704 830 2+
1039 647.25176 156
1040 647.80114 146
1041 649.30472 199
1042 650.33384 120
1043 650.81514 2595 2+
1044 653.82526 207
1045 655.80508 2241 2+
1046 660.83658 3736 2+
1047 663.07854 123
1048 664.30132 181
1049 664.80298 18684 2+
1050 671.35358 207
1051 672.41659 361 1+
1052 673.30939 110
1053 674.35229 169
1054 675.37445 175
1055 676.35819 164
1056 677.84090 132
1057 679.35167 115
1058 689.33735 114
1059 689.89197 150
1060 690.01782 419 3+
1061 691.29692 133
1062 692.35847 124
1063 693.33892 134
1064 695.35443 241
1065 697.44642 153
1066 698.42549 170
1067 698.86943 1051 2+
1068 701.37626 234
1069 703.33084 178
1070 704.38999 118
1071 707.35278 765
1072 707.84300 773 1+
1073 708.34235 13292 1+
1074 712.33910 1557 2+
1075 716.39360 139
1076 719.29971 137
1077 720.31536 216
1078 720.83411 230
1079 721.34764 8534 2+
1080 724.34821 180
1081 726.36321 952 1+
1082 726.84885 223
1083 728.33712 687 2+
1084 729.35919 1720 2+
1085 732.33765 110
1086 734.38419 148
1087 735.35605 141
1088 736.36326 119
1089 739.35273 2542 1+
1090 744.36217 525 1+
1091 746.41170 689 2+
1092 748.03728 146
1093 748.40411 171
1094 749.04836 128
1095 749.38305 118
1096 751.82728 121
1097 752.40350 193
1098 753.03687 1212 3+
1099 755.37990 160
1100 756.08866 114
1101 756.42711 231
1102 757.39729 219
1103 757.62012 132
1104 757.83844 134
1105 758.40343 360
1106 758.74559 344
1107 759.10415 358
1108 759.38788 3939 3+
1109 761.40140 828 2+
1110 762.73573 114
1111 763.40466 229
1112 764.38571 910 2+
1113 765.09973 132
1114 769.40839 112
1115 770.37855 146
1116 771.37886 204
1117 772.35768 142
1118 773.40417 138
1119 776.36445 260
1120 776.88365 1081 2+
1121 784.49747 472
1122 785.37680 7884 2+
1123 794.36832 161
1124 795.35192 192
1125 801.39390 131
1126 808.37801 2038 1+
1127 813.41920 256
1128 818.40892 342
1129 819.39351 1859 1+
1130 826.38407 3598 1+
1131 831.41118 158
1132 836.41084 12679 1+
1133 836.88591 423 1+
1134 841.90431 1428 2+
1135 850.89545 4998 2+
1136 885.45678 167
1137 886.48684 115
1138 890.46588 222
1139 891.44626 126
1140 893.45849 213
1141 893.92278 246
1142 897.59888 120
1143 898.46220 773 1+
1144 907.44493 3353 2+
1145 911.39748 134
1146 912.49910 203
1147 913.00629 158
1148 914.45001 157
1149 915.41642 153
1150 929.44132 225
1151 930.44109 521 1+
1152 939.41811 2308 1+
1153 949.49274 4403 1+
1154 957.43066 6601 1+
1155 972.96604 1049 2+
1156 976.49873 117
1157 990.48264 144
1158 1000.57780 141
1159 1011.57709 181
1160 1030.50110 178
1161 1030.97479 174
1162 1031.50744 186
1163 1032.03398 115
1164 1060.52750 122
1165 1061.48406 231
1166 1066.01033 127
1167 1066.47287 140
1168 1066.99831 110
1169 1070.51379 2466 1+
1170 1078.53763 2784 1+
1171 1112.66418 145
1172 1189.56617 613 1+
1173 1199.55187 841 1+
1174 1207.58359 2222 1+
1175 1320.67707 138
1176 1328.59868 923 1+
1177 1441.64792 114
1178 END IONS
1179
1180 BEGIN IONS
1181 TITLE= Cmpd 736, +MSn(742.0258), 75.1 min
1182 PEPMASS=742.02585 165812
1183 CHARGE=3+
1184 159.08980 174
1185 181.08178 124
1186 186.07989 263
1187 187.09802 716 1+
1188 201.10260 212
1189 203.09432 94
1190 204.08646 487 1+
1191 207.10135 106
1192 211.13642 84
1193 215.10495 263
1194 218.14330 612
1195 228.13904 110
1196 229.11429 731 1+
1197 231.11088 774
1198 232.13167 1667 1+
1199 246.11784 327 1+
1200 249.12688 2959 1+
1201 259.10837 1512 1+
1202 262.16651 94
1203 263.11048 174
1204 272.15881 328
1205 274.12482 503 1+
1206 277.11952 2699 1+
1207 286.15185 158
1208 290.17803 205
1209 292.13272 472 1+
1210 300.16843 119
1211 303.12083 867 1+
1212 311.17349 87
1213 314.17049 107
1214 316.16066 406
1215 318.17833 578 1+
1216 325.19160 490 1+
1217 327.20373 110
1218 329.16000 310 1+
1219 332.10718 104
1220 333.16463 134
1221 339.23765 494 1+
1222 342.15589 87
1223 343.15875 219 2+
1224 344.15334 505
1225 345.22670 536 1+
1226 346.12874 96
1227 347.19049 676 1+
1228 352.67974 299 2+
1229 355.18185 262 1+
1230 358.15422 384 1+
1231 361.20337 86
1232 362.18483 148
1233 363.16547 464 1+
1234 366.15465 128
1235 368.18478 264 2+
1236 373.17532 322
1237 374.14586 2825 1+
1238 385.22920 110
1239 387.18739 161
1240 388.19823 1318 2+
1241 390.19969 83
1242 392.15200 2915 1+
1243 397.19765 267 1+
1244 402.16826 85
1245 408.19435 187
1246 410.19253 103
1247 415.20375 140
1248 416.20251 592 2+
1249 417.21732 230
1250 422.70608 93
1251 425.21728 965 2+
1252 427.19339 508 1+
1253 430.69821 578 2+
1254 432.28406 169
1255 434.20114 333 1+
1256 436.23697 649 2+
1257 440.25708 167
1258 441.72704 163 2+
1259 443.21855 1876 2+
1260 445.21311 4227 2+
1261 446.21484 1751 1+
1262 452.22932 4728 2+
1263 455.19503 218 1+
1264 457.21462 116
1265 458.23703 975 1+
1266 459.23443 350 2+
1267 462.22047 4049 1+
1268 468.28185 984 1+
1269 470.73924 150
1270 471.23561 455 2+
1271 473.20804 7411 1+
1272 473.74271 102
1273 478.26696 214
1274 479.73515 83
1275 480.26714 203 1+
1276 481.75145 859 2+
1277 485.26492 198 2+
1278 486.25371 1373 1+
1279 489.76778 91
1280 490.24037 257 2+
1281 491.23499 4040 1+
1282 491.77179 138
1283 493.28773 166
1284 499.26008 319 2+
1285 502.25187 558 1+
1286 502.75462 84
1287 503.20783 88
1288 506.26577 506 1+
1289 509.70150 326 2+
1290 511.26317 274 1+
1291 513.27177 577 2+
1292 516.27131 178
1293 517.22997 426 1+
1294 520.19345 175
1295 521.20235 355 1+
1296 522.74814 117
1297 523.25304 407 2+
1298 525.25314 540 1+
1299 525.75664 131
1300 527.73076 116
1301 528.24962 433 1+
1302 529.77740 92
1303 530.74093 96
1304 533.75985 4610 2+
1305 535.27433 1242 1+
1306 535.75603 444 9+
1307 538.72229 111
1308 539.29367 1227 2+
1309 541.70083 117
1310 542.26161 188 1+
1311 544.27532 849 2+
1312 545.22527 103
1313 546.23923 119
1314 546.79061 530 1+
1315 547.25253 84
1316 548.23173 174
1317 549.27774 541 2+
1318 553.15504 85
1319 553.30745 107
1320 554.27690 292 1+
1321 556.27330 367 1+
1322 558.30705 1017 1+
1323 561.78360 100
1324 562.80312 1134 2+
1325 565.78727 386
1326 566.28092 562 1+
1327 569.26728 370 2+
1328 570.78345 2276 2+
1329 572.63294 341 3+
1330 574.27745 261
1331 575.30363 3357 1+
1332 578.62983 122
1333 579.28557 1353 1+
1334 579.79483 2783 2+
1335 580.29672 1280 4+
1336 582.77780 453 1+
1337 583.29600 121
1338 584.25407 447 1+
1339 585.92192 3637 3+
1340 587.79615 386 2+
1341 589.66585 84
1342 591.81375 100
1343 592.25182 957 1+
1344 594.81054 97
1345 596.26228 168
1346 597.31721 673 1+
1347 599.78228 117
1348 602.25403 5768 1+
1349 603.62258 97
1350 605.96479 137
1351 606.82366 441 2+
1352 610.30632 281 1+
1353 611.64525 357 6+
1354 612.29681 380 1+
1355 612.75444 109
1356 616.35435 228 3+
1357 617.03766 186 4+
1358 618.26293 243 1+
1359 620.27596 5448 1+
1360 621.76971 106
1361 622.68409 83
1362 622.83094 661 2+
1363 625.29237 88
1364 625.78190 104
1365 626.33886 136
1366 628.27945 191
1367 629.29739 590 1+
1368 629.82608 99
1369 632.28115 549 2+
1370 632.76617 627 1+
1371 634.29647 115
1372 635.32907 95
1373 636.27585 239 1+
1374 636.39852 90
1375 637.18040 144 7+
1376 638.29481 316 1+
1377 638.83423 85
1378 639.79219 722 2+
1379 640.31638 1161 1+
1380 640.79691 697 2+
1381 643.81868 108
1382 644.64412 90
1383 644.96661 88
1384 645.34618 114
1385 645.97960 94
1386 646.30466 1685 1+
1387 647.82074 262
1388 649.99788 580 3+
1389 652.32147 2230 2+
1390 653.67359 97
1391 654.32480 370 2+
1392 656.31977 94
1393 657.30823 112
1394 658.35195 108
1395 658.65971 234
1396 658.97641 1262 3+
1397 660.81875 1024 1+
1398 661.32081 2361 2+
1399 664.31558 387 1+
1400 666.32068 499 3+
1401 667.30457 686 3+
1402 667.74786 87
1403 668.33703 261
1404 668.78833 116
1405 669.37222 177
1406 669.83755 824 2+
1407 670.37882 1361 1+
1408 672.82138 281 1+
1409 673.61926 93
1410 674.29118 887 1+
1411 677.87776 94
1412 679.29663 124
1413 679.74129 90
1414 680.30500 533 3+
1415 682.33215 327 1+
1416 683.72592 379 2+
1417 684.80700 746 4+
1418 685.31023 855 1+
1419 686.83583 89
1420 687.76613 109
1421 688.28853 1088 2+
1422 689.73957 89
1423 690.33445 575 2+
1424 693.34733 1024 2+
1425 694.70008 93
1426 695.29583 97
1427 695.90047 87
1428 696.34235 111
1429 697.84007 1515 2+
1430 698.33418 1187 1+
1431 698.99638 547 3+
1432 702.37400 1412 1+
1433 702.81833 128
1434 703.65467 89
1435 703.81698 347 1+
1436 704.34231 6470 1+
1437 705.99865 109
1438 706.66913 264 1+
1439 707.68209 535 3+
1440 709.38924 928 1+
1441 712.80294 119
1442 713.35000 134
1443 713.78609 117
1444 714.32161 532 2+
1445 716.34537 1629 2+
1446 716.35961 1571 1+
1447 718.84353 161
1448 720.59615 542 4+
1449 720.84726 303 1+
1450 721.37492 440 2+
1451 723.33317 120
1452 725.35369 3524 2+
1453 728.70060 84
1454 730.02611 907 3+
1455 732.30657 201
1456 732.85656 95
1457 733.36053 544 3+
1458 734.84659 117
1459 735.36229 3033 1+
1460 735.72656 90
1461 736.02930 4871 3+
1462 737.90346 3022 2+
1463 738.62274 483 1+
1464 740.37407 551
1465 740.61343 531 4+
1466 741.37030 642
1467 742.03654 17503 3+
1468 742.70758 7140 6+
1469 743.89564 1859 2+
1470 744.42153 1504 4+
1471 744.88234 1840 1+
1472 745.22913 782 5+
1473 745.40636 2844 1+
1474 745.91059 3126 2+
1475 746.12795 92
1476 746.71909 247
1477 747.61193 88
1478 748.01362 122
1479 750.37002 94
1480 751.41918 107
1481 751.86658 1818 2+
1482 752.65796 94
1483 754.39376 539 2+
1484 758.36831 104
1485 759.88574 100
1486 760.30091 84
1487 760.86983 1362 2+
1488 767.41389 145
1489 773.43904 86
1490 774.39852 132
1491 774.84982 121
1492 775.38919 9052 1+
1493 781.37566 91
1494 782.35803 348 2+
1495 784.39807 94
1496 787.36657 93
1497 789.32901 190
1498 790.85978 97
1499 792.39692 166
1500 793.90793 1801 2+
1501 796.28307 212
1502 797.25145 84
1503 798.38085 122
1504 799.38378 426 2+
1505 801.31821 91
1506 801.90339 114
1507 802.42359 147
1508 802.92255 15579 2+
1509 805.50131 214 1+
1510 805.94539 112
1511 811.39548 87
1512 811.88225 417 2+
1513 813.39613 488 1+
1514 816.38893 270
1515 816.90875 150
1516 817.38469 576 1+
1517 821.41937 104
1518 822.04668 928 3+
1519 824.41314 87
1520 825.38857 817 2+
1521 829.39659 96
1522 829.84269 200 1+
1523 830.43747 861
1524 831.43164 1632 1+
1525 839.39575 191 1+
1526 847.45510 90
1527 848.45609 117
1528 849.42729 1993 1+
1529 858.44577 1495 2+
1530 860.38915 645 1+
1531 867.44125 7291 2+
1532 870.42178 141
1533 871.46666 571 1+
1534 871.90234 89
1535 876.39322 451 2+
1536 878.37925 2072 2+
1537 881.93675 118
1538 882.44680 269 1+
1539 882.90840 116
1540 884.48962 98
1541 885.42983 857 1+
1542 895.44148 115
1543 896.39596 98
1544 897.46150 109
1545 899.47692 92
1546 901.48406 325 1+
1547 903.45136 3218 1+
1548 908.92563 302 2+
1549 916.97569 1939 2+
1550 917.46158 1029 1+
1551 924.35595 83
1552 929.46465 93
1553 935.48109 106
1554 939.42540 112
1555 940.44591 84
1556 941.44235 86
1557 947.46364 84
1558 959.48647 467 1+
1559 962.49563 480 1+
1560 966.46724 93
1561 974.49318 3399 2+
1562 978.51696 173
1563 979.52985 100
1564 995.46483 113
1565 995.93771 105
1566 996.47135 92
1567 1020.57668 125
1568 1025.55424 140
1569 1028.94160 100
1570 1030.53525 152
1571 1031.52956 120
1572 1045.49881 344 1+
1573 1049.57477 128
1574 1066.51242 782 1+
1575 1069.50191 493 1+
1576 1077.51095 88
1577 1079.50871 127
1578 1124.59896 539 1+
1579 1137.50842 99
1580 1140.55963 1021 1+
1581 1158.61139 571 1+
1582 1281.52850 166
1583 1303.63566 271 1+
1584 1321.64611 140
1585 END IONS
1586
1587 BEGIN IONS
1588 TITLE= Cmpd 582, +MSn(590.6452), 63.2 min
1589 PEPMASS=590.64518 208523
1590 CHARGE=3+
1591 159.07516 11278 1+
1592 169.11384 263
1593 170.04971 442
1594 173.11246 373
1595 175.10666 1007
1596 185.05168 560
1597 186.10854 272
1598 187.07915 1725
1599 188.07977 340
1600 201.11376 585
1601 215.10078 2408 1+
1602 217.07583 1194
1603 226.15452 423
1604 227.07621 769
1605 235.13355 324
1606 243.14532 20486 2+
1607 245.07733 6715 1+
1608 254.15181 406
1609 263.14226 950 2+
1610 270.12385 537
1611 271.65721 16451 2+
1612 281.11337 730
1613 283.14504 454
1614 288.14004 597
1615 289.16404 5403 1+
1616 298.12410 1150
1617 299.68191 1119 2+
1618 301.15349 645
1619 311.16224 275
1620 316.15057 3529 1+
1621 326.14677 250
1622 327.20151 608
1623 327.69674 286
1624 328.20254 239
1625 336.20683 904
1626 341.20051 4859 2+
1627 343.16505 243
1628 344.15117 2023 1+
1629 349.16630 338
1630 350.20516 4234 2+
1631 355.14794 249
1632 355.69345 279
1633 356.18668 13784 2+
1634 364.69830 25329 2+
1635 369.19212 278
1636 371.20867 302
1637 372.18863 238
1638 373.15854 270
1639 376.73774 578
1640 377.24643 390
1641 385.15615 410
1642 385.74330 379
1643 386.24277 620
1644 387.19072 1632
1645 388.22511 3145 2+
1646 389.23314 762
1647 390.73609 7186 2+
1648 396.22934 312
1649 398.22118 236
1650 399.22572 439
1651 399.74090 2203 2+
1652 411.20354 266
1653 411.70917 343
1654 413.15329 537
1655 414.23685 2937 1+
1656 420.21767 1109
1657 420.71812 576
1658 429.21978 3407 2+
1659 431.16214 1317
1660 432.16236 482
1661 439.21432 283
1662 439.70760 265
1663 444.23050 296
1664 445.20500 948
1665 446.21975 357
1666 448.24901 4341 2+
1667 457.25695 6224 2+
1668 461.27312 305
1669 462.25899 258
1670 467.26950 488
1671 468.25985 1296
1672 468.72544 876
1673 469.22925 633
1674 470.26575 799
1675 471.26597 328
1676 472.24739 259
1677 477.73071 1534
1678 478.23734 1058
1679 478.72278 319
1680 479.19611 249
1681 482.27858 260
1682 483.26720 368
1683 484.22414 388
1684 485.28336 59339 1+
1685 485.75974 320
1686 486.74178 4735 2+
1687 488.20096 1003
1688 489.21515 396
1689 497.25673 326
1690 498.24217 437
1691 498.77422 410
1692 499.31921 1473
1693 500.30209 890
1694 502.23998 355
1695 507.77969 877
1696 508.27629 712
1697 509.28933 275
1698 510.25140 302
1699 512.22526 310
1700 512.77764 1094
1701 513.26998 789
1702 515.25466 333
1703 516.23520 1358
1704 517.23719 434
1705 521.18863 412
1706 521.77961 7740 2+
1707 524.28879 573
1708 525.27725 2374 1+
1709 527.31860 11710 1+
1710 527.78134 713
1711 530.23677 719
1712 531.23398 316
1713 534.25659 256
1714 536.26832 1065
1715 536.77784 598
1716 537.26744 349
1717 538.25612 284
1718 539.29591 280
1719 541.62934 396
1720 541.78347 287
1721 541.96521 645
1722 542.30714 118146 1+
1723 542.78779 385
1724 551.27404 713
1725 552.26840 240
1726 553.31011 368
1727 554.27683 267
1728 555.30579 262
1729 556.28764 833
1730 556.79047 499
1731 557.28579 437
1732 558.27484 247
1733 565.27569 599
1734 566.27459 375
1735 569.29042 263
1736 570.34996 703
1737 571.29778 555
1738 571.73932 251
1739 572.27664 287
1740 572.78171 254
1741 575.78771 241
1742 576.27969 264
1743 576.77666 268
1744 577.79174 383
1745 578.64190 390
1746 578.78123 277
1747 578.97689 785
1748 579.30225 331
1749 580.32160 393
1750 581.29572 262
1751 582.80428 624
1752 583.28842 480
1753 583.70976 301
1754 584.23638 515
1755 584.64514 5081 3+
1756 584.78101 1313
1757 585.79369 404
1758 586.31092 667
1759 586.79024 774
1760 587.28812 1031
1761 587.79228 370
1762 588.28572 450
1763 589.29488 422
1764 589.69865 4558 1+
1765 590.21805 1408
1766 591.21780 1530
1767 591.79727 8758 2+
1768 594.31972 801
1769 594.78932 546
1770 595.29609 550
1771 596.31406 258
1772 597.30815 571
1773 598.35655 12047 1+
1774 600.82043 4995 2+
1775 605.80973 764
1776 606.31960 666
1777 606.81646 314
1778 607.31347 238
1779 613.31436 370
1780 614.30647 281
1781 614.81970 6689 2+
1782 620.32101 260
1783 620.82354 322
1784 621.32466 294
1785 622.31566 397
1786 626.39924 281
1787 629.32746 648
1788 629.82906 328
1789 630.31863 300
1790 631.27981 708
1791 632.28783 250
1792 634.32671 684
1793 634.81955 611
1794 635.31253 353
1795 638.33582 244
1796 643.33147 8650 2+
1797 652.36309 312
1798 654.36727 237
1799 655.37090 533
1800 656.34034 459
1801 657.33843 264
1802 666.33411 330
1803 668.35158 252
1804 671.40273 471
1805 672.41190 258
1806 678.36403 373
1807 681.39374 7233 1+
1808 692.34579 324
1809 699.40305 16735 1+
1810 711.36609 1235 1+
1811 726.31929 290
1812 728.38933 31818 1+
1813 739.40746 236
1814 754.44640 272
1815 770.46518 569
1816 771.43561 240
1817 775.44294 350 1+
1818 780.46490 3056 1+
1819 798.47452 12593 1+
1820 839.40935 875
1821 840.43044 582
1822 857.43229 5216 1+
1823 895.49075 647 1+
1824 913.50662 11105 1+
1825 929.48512 237
1826 954.44740 454
1827 955.45023 460
1828 972.47627 7910 1+
1829 1014.55894 299
1830 1024.53406 566
1831 1025.55066 510
1832 1042.55194 19121 1+
1833 1071.52968 275
1834 1156.58806 700
1835 1157.60402 539
1836 1158.56840 261
1837 1228.63212 755 1+
1838 1285.65567 692 1+
1839 END IONS
1840
1841 BEGIN IONS
1842 TITLE= Cmpd 72, +MSn(428.2391), 26.6 min
1843 PEPMASS=428.23909 998365
1844 CHARGE=3+
1845 159.06232 5635 1+
1846 161.07525 1774
1847 171.06568 3923 1+
1848 173.11119 7054 1+
1849 175.10289 1261
1850 183.10287 4304 2+
1851 185.08708 939
1852 189.07783 5645 1+
1853 192.60777 1450
1854 193.10729 3602 2+
1855 197.14441 1228
1856 199.17417 133816 1+
1857 201.11663 11094 1+
1858 206.12293 826
1859 213.09252 831
1860 213.11574 471 4+
1861 214.11581 4508
1862 215.09783 7534 1+
1863 219.08306 1460
1864 221.11038 789
1865 222.12209 394 2+
1866 223.14635 1345
1867 224.10726 1556
1868 225.15311 1356
1869 227.17299 36108 1+
1870 229.12047 1613
1871 232.12574 1974
1872 235.13800 814
1873 242.12341 11292 2+
1874 243.12805 1431
1875 244.12805 1846
1876 244.64612 1099
1877 245.13347 596 2+
1878 246.63161 5719 2+
1879 248.13870 803
1880 249.11318 1645
1881 249.63518 778 2+
1882 251.14138 1095
1883 252.63563 3304 2+
1884 254.14973 6366 1+
1885 255.63872 20478 2+
1886 258.14593 1367
1887 260.13318 22170 1+
1888 264.66399 782
1889 266.14644 15009 1+
1890 269.16198 1990
1891 270.16118 2109
1892 272.16274 2219
1893 273.15970 961
1894 274.18250 1990
1895 275.17058 1048
1896 275.65918 1403
1897 276.14395 857
1898 277.66992 1885
1899 278.16116 5360 2+
1900 283.15720 878
1901 284.17008 39580 2+
1902 285.16536 7744 2+
1903 286.15361 1325
1904 287.16378 1332 2+
1905 288.15985 2511 3+
1906 289.15806 846
1907 290.15078 3933 2+
1908 293.13593 823
1909 294.14433 881
1910 295.13948 1469
1911 296.19241 5743 1+
1912 298.16971 5951 2+
1913 299.15574 27134 2+
1914 301.15498 2336
1915 302.16008 3457 2+
1916 303.14385 1245
1917 304.16888 906
1918 306.17564 1827 3+
1919 309.16906 791
1920 309.66575 990
1921 310.18230 1283
1922 311.14099 16286 1+
1923 314.19585 7031 1+
1924 315.66574 795
1925 319.16507 986
1926 322.67589 1742
1927 323.17570 1764
1928 327.19450 1350
1929 328.18666 2141
1930 329.15067 33623 1+
1931 329.71466 1050
1932 333.69156 1573 2+
1933 334.69578 1163
1934 335.18954 1038
1935 336.16998 1200
1936 337.19185 1174
1937 339.21320 807
1938 340.17153 2118
1939 341.18466 2560
1940 342.19072 842
1941 343.19601 1785
1942 343.70583 850
1943 345.20501 2464
1944 346.16717 1219
1945 346.69097 902
1946 347.16872 9370 2+
1947 348.16884 1608
1948 353.18480 1284
1949 355.20773 5283
1950 355.69804 10534 2+
1951 357.21169 1441
1952 358.16966 4492 2+
1953 359.18435 1451
1954 364.19075 13061 2+
1955 367.21304 4024 2+
1956 368.21715 1066
1957 371.20117 3787 2+
1958 372.20706 1497
1959 373.22464 26532 2+
1960 375.22001 1605
1961 377.19593 875
1962 378.20799 1413
1963 379.20999 1161
1964 380.18586 1392
1965 381.19930 1399
1966 381.86423 1279
1967 382.18487 4858 2+
1968 383.20667 2118
1969 384.21620 823
1970 385.20730 9193 1+
1971 387.54209 7008
1972 387.87218 13863 3+
1973 389.21509 9916 1+
1974 390.54576 1153
1975 390.71444 1291
1976 394.20730 1024
1977 395.20802 4806 2+
1978 396.22276 2190
1979 397.22842 2436
1980 398.20352 2294
1981 399.21473 19096 2+
1982 401.20648 921
1983 401.72280 948
1984 402.22260 865
1985 404.20910 808
1986 405.21391 817
1987 406.21042 2146
1988 407.20959 1167
1989 409.23785 1318
1990 410.22690 867
1991 411.24784 1171
1992 412.23674 1078
1993 413.22164 19687 1+
1994 413.55520 3426 1+
1995 413.89098 1822
1996 418.72343 5873 2+
1997 420.74065 1305
1998 421.24475 6072 2+
1999 421.57588 1260
2000 421.90896 921
2001 422.23882 8328 3+
2002 422.71060 1109
2003 423.21344 7472
2004 424.22181 13629 2+
2005 425.22421 4441 2+
2006 426.22980 1695
2007 427.23642 2055
2008 427.73085 1579
2009 428.24071 6120
2010 428.57039 17898 3+
2011 428.74129 1312
2012 429.77089 138330 2+
2013 431.73614 17680 2+
2014 433.23011 2256
2015 434.21067 1144
2016 436.25599 1339
2017 440.25616 882
2018 440.73386 29731 2+
2019 442.23619 20588
2020 443.23691 7192 1+
2021 445.72993 870
2022 446.23776 1003
2023 447.22624 819
2024 448.24147 958
2025 449.23497 830
2026 449.73957 96641 2+
2027 451.20749 13939 2+
2028 452.20821 4577 2+
2029 453.22313 1101
2030 454.26078 1685
2031 454.74090 1312
2032 455.23953 1390
2033 455.73090 972
2034 456.23451 999
2035 458.27236 1223
2036 458.75982 7271 2+
2037 460.24464 13219 1+
2038 466.25317 1728
2039 467.24531 4832 2+
2040 468.27305 3811
2041 469.24050 13848 1+
2042 474.24342 2321
2043 475.25299 986
2044 476.25248 14341 2+
2045 478.23668 1148
2046 480.25389 1413
2047 481.25431 1057
2048 483.23955 3159 1+
2049 485.25932 32345 2+
2050 487.27673 1908
2051 488.25366 1187
2052 489.25967 6369 1+
2053 492.25594 12798 1+
2054 496.26841 1247
2055 497.26121 1005
2056 497.75788 1885
2057 498.26309 4636 1+
2058 501.26151 1408
2059 501.75602 1325
2060 502.26121 2549
2061 502.75321 969
2062 503.26212 1011
2063 504.26398 12640 1+
2064 508.25504 886
2065 509.29280 1091
2066 510.27016 128761 1+
2067 510.76738 42296 2+
2068 514.25977 2427
2069 515.26401 1089
2070 516.25791 1194
2071 519.29037 2534
2072 519.76919 62259 2+
2073 522.28618 987
2074 526.27092 1023
2075 527.31443 2155
2076 528.30147 2456
2077 528.77449 170196 2+
2078 532.27949 5525 1+
2079 532.79730 865
2080 533.76579 1202
2081 536.28029 1631
2082 537.30140 15007 1+
2083 545.32013 2034
2084 546.29051 2224
2085 547.28567 10409 1+
2086 553.31138 1032
2087 555.31504 18492 1+
2088 561.28731 1271
2089 562.29409 838
2090 564.28335 2236
2091 565.29739 1125
2092 567.33288 4391 1+
2093 567.80730 903
2094 571.32071 1427
2095 572.31918 813
2096 573.32029 9749 1+
2097 576.31053 11036 2+
2098 578.30199 1945
2099 579.29427 20915 1+
2100 585.31570 33756 2+
2101 588.32861 1287
2102 589.30624 2313
2103 590.30081 7173 1+
2104 595.33214 7646 1+
2105 597.30421 181715 1+
2106 603.31288 661 1+
2107 615.32578 1060
2108 616.35227 2218
2109 617.35100 52434 1+
2110 622.35749 820
2111 623.31970 1521
2112 624.33566 1158
2113 629.33253 1383
2114 630.33052 1184
2115 632.35367 881
2116 639.34457 1103
2117 640.36049 835
2118 642.34670 938
2119 647.33548 1941
2120 648.33760 1727
2121 650.36853 1353
2122 651.31987 2152
2123 652.32280 969
2124 660.35647 1068
2125 666.37585 3998 1+
2126 668.39018 2204
2127 669.35281 1715
2128 685.39003 1602
2129 686.38600 1350
2130 689.33891 963
2131 690.36065 1267
2132 692.37602 2639
2133 693.33017 2585 1+
2134 710.38881 49024 1+
2135 715.33205 578 1+
2136 724.36936 902
2137 727.37423 1714 1+
2138 733.41880 1422 1+
2139 741.39506 284 1+
2140 745.44201 15507 1+
2141 752.36032 1512
2142 753.36071 823
2143 755.39352 939
2144 763.36247 837 1+
2145 770.37294 1049
2146 779.41338 5910 1+
2147 789.40876 481 1+
2148 797.42217 59705 1+
2149 841.48223 371 1+
2150 847.43634 604 1+
2151 862.46500 1543 1+
2152 880.46044 4106 1+
2153 898.47187 33851 1+
2154 903.40914 243 1+
2155 910.43294 1209
2156 951.49768 808 1+
2157 969.51137 5492 1+
2158 1020.52748 233 1+
2159 1038.53110 811 1+
2160 1056.54170 4080 1+
2161 END IONS
2162
2163 BEGIN IONS
2164 TITLE= Cmpd 875, +MSn(483.2538), 89.2 min
2165 PEPMASS=483.25374 16982
2166 CHARGE=3+
2167 155.07949 167
2168 157.08688 317
2169 158.07506 316
2170 172.05681 496
2171 175.10342 4431 1+
2172 177.09597 624
2173 177.59012 138 2+
2174 183.10139 352
2175 184.09871 178
2176 185.14984 164
2177 197.11776 656
2178 199.10192 769 2+
2179 200.12300 1118 1+
2180 206.12910 586
2181 207.63892 219
2182 208.12306 166
2183 211.11270 188
2184 213.07963 472
2185 214.08866 149
2186 215.13682 2296 1+
2187 218.14016 1816 2+
2188 221.13227 1038 2+
2189 225.12638 600
2190 226.12661 296
2191 228.13285 1681 2+
2192 229.64619 367
2193 230.13192 176
2194 231.10540 1471 1+
2195 233.16646 383
2196 234.62563 197 2+
2197 239.14618 238
2198 240.13334 884
2199 241.08298 2615 1+
2200 243.13133 3786 2+
2201 244.13686 522
2202 246.14932 150
2203 248.13933 218
2204 249.12686 357
2205 250.15007 438
2206 252.15856 142
2207 257.14620 1076 2+
2208 258.12768 196
2209 259.09643 2839 1+
2210 261.16917 305
2211 265.16969 245
2212 268.12885 458
2213 270.16903 158
2214 271.14322 7957 1+
2215 273.65743 696 2+
2216 277.10932 330
2217 281.14644 188
2218 282.66121 991 2+
2219 284.83124 136
2220 285.15842 1491 1+
2221 288.20520 6472 1+
2222 294.18715 184
2223 296.18139 141
2224 299.15296 180
2225 303.66175 147
2226 304.13603 268
2227 306.11735 143
2228 308.17249 345
2229 309.17813 273
2230 311.08415 138
2231 312.17209 180
2232 312.64195 200
2233 313.14916 836 2+
2234 315.13905 138
2235 321.65998 1248 2+
2236 324.14301 143
2237 326.18039 374
2238 327.18884 178
2239 330.19531 534 2+
2240 337.16372 160
2241 338.19688 174
2242 339.20521 6683 2+
2243 342.20850 264
2244 344.19818 390
2245 345.20631 213
2246 346.16176 160
2247 351.18454 227
2248 352.13066 415
2249 353.14595 161
2250 354.17297 1741 1+
2251 354.66347 163
2252 356.22783 5252 1+
2253 359.65106 189
2254 363.20462 197
2255 366.21615 161
2256 366.94473 192
2257 367.04557 136
2258 367.20430 280
2259 368.18597 369
2260 369.15276 1776 1+
2261 370.93138 187
2262 371.23639 269
2263 372.18299 1815 2+
2264 373.19491 361
2265 375.20367 199
2266 377.17873 332
2267 377.66715 524 2+
2268 379.17773 206
2269 382.16325 1078 1+
2270 384.21929 6105 1+
2271 386.18354 1733 2+
2272 388.15443 1191 1+
2273 393.20545 272
2274 393.68394 142
2275 394.75327 224
2276 396.17138 170
2277 397.19657 1690 1+
2278 400.19525 974 1+
2279 403.70872 260
2280 409.25236 136
2281 411.21304 217
2282 414.19568 1682 1+
2283 418.24742 428
2284 419.23737 424
2285 420.23139 255
2286 421.24553 158
2287 425.16683 191
2288 429.23298 196
2289 430.18225 286
2290 433.21960 185
2291 433.71026 150
2292 434.58820 135
2293 435.27304 26795 1+
2294 436.11017 332
2295 440.23589 168
2296 441.25727 644 1+
2297 442.72522 255 2+
2298 443.78326 141
2299 447.17711 147
2300 448.17449 167
2301 450.23322 1185 2+
2302 451.21132 346
2303 452.14985 152
2304 452.29266 210
2305 453.22809 200
2306 454.20605 209
2307 455.25843 656 1+
2308 459.24611 1248 2+
2309 463.27061 284
2310 464.26725 145
2311 464.79005 139
2312 465.20127 402
2313 466.23053 228
2314 467.21115 346
2315 468.24398 2414 1+
2316 471.23303 135
2317 473.31905 262
2318 474.22894 250
2319 477.23109 182
2320 478.22429 414
2321 479.24797 251
2322 480.20943 240
2323 481.23164 308
2324 481.65213 222
2325 482.27673 438
2326 483.23271 2297 1+
2327 483.77864 386
2328 485.25538 3375 1+
2329 485.66150 259
2330 485.85535 222
2331 486.64383 255
2332 486.81258 176
2333 488.78208 153
2334 489.77086 153
2335 490.18935 149
2336 493.21540 144
2337 494.22453 184
2338 495.26087 1375
2339 496.24246 3301 1+
2340 501.22214 1512 1+
2341 505.75130 157
2342 507.25890 153
2343 508.21492 597
2344 510.27498 171
2345 511.21342 542
2346 512.21360 389
2347 513.26817 5644 1+
2348 514.76114 139
2349 522.27511 194
2350 525.23056 334
2351 526.22951 1141 1+
2352 529.25074 380
2353 530.23686 144
2354 534.31627 161
2355 543.23519 1235 1+
2356 546.30758 6693 1+
2357 554.25370 149
2358 561.26285 185
2359 562.26069 221
2360 564.31515 44659 1+
2361 564.75055 135
2362 565.70261 158
2363 571.25361 180
2364 574.31008 215
2365 578.32863 138
2366 579.28334 479
2367 580.29181 321
2368 581.29397 263
2369 583.28734 142
2370 584.29412 133
2371 594.30031 260
2372 597.29754 1354 1+
2373 600.30764 233
2374 601.29748 139
2375 606.31193 163
2376 607.27124 514
2377 608.27928 260
2378 612.27070 164
2379 613.24908 140
2380 614.30743 1238 1+
2381 623.28131 180
2382 624.31148 1033
2383 625.29105 3067 1+
2384 637.23271 179
2385 638.28600 245
2386 639.30603 213
2387 640.26960 227
2388 641.29423 236
2389 642.31268 4307 1+
2390 648.35471 163
2391 654.27805 373
2392 655.26516 588
2393 656.26166 156
2394 657.30167 362
2395 658.27896 265
2396 659.38334 1372 1+
2397 664.87804 173
2398 667.34365 145
2399 672.29579 1330 1+
2400 677.40315 15632 1+
2401 682.39027 134
2402 687.40092 162
2403 708.33908 259
2404 709.32292 265
2405 710.40005 145
2406 718.37144 211
2407 725.34852 226
2408 726.33687 637
2409 727.36245 218
2410 735.33275 187
2411 736.33300 1115 1+
2412 740.36282 163
2413 743.35869 1134 1+
2414 753.34184 1509
2415 754.32703 5220 1+
2416 768.36125 214
2417 770.43124 281
2418 771.35980 7912 1+
2419 785.37036 454
2420 788.43502 1596 1+
2421 806.44637 3764 1+
2422 848.39827 146
2423 856.45870 230
2424 866.46417 185
2425 867.41631 403
2426 868.42968 324
2427 884.44316 1130 1+
2428 899.45917 388 1+
2429 917.48494 462 1+
2430 935.48451 1273 1+
2431 1013.45897 151
2432 1047.52379 136
2433 1064.55252 193
2434 1065.51811 223
2435 END IONS
2436
2437 BEGIN IONS
2438 TITLE= Cmpd 207, +MSn(785.9179), 35.7 min
2439 PEPMASS=785.91791 103759
2440 CHARGE=2+
2441 168.05094 846
2442 186.06702 3315 1+
2443 200.13280 1616 1+
2444 204.08177 9197 1+
2445 228.12926 2310 1+
2446 242.14767 176
2447 243.14199 216
2448 248.07130 222
2449 249.16146 263
2450 260.19112 1185 1+
2451 263.13345 229
2452 277.15209 139
2453 303.13061 167
2454 313.22642 489
2455 314.23651 137
2456 341.22289 3046 1+
2457 357.19189 386
2458 364.16370 1084 1+
2459 366.14662 2402 1+
2460 375.21190 144
2461 391.20707 159
2462 402.23773 337
2463 403.17219 207
2464 407.17527 334
2465 408.23101 145
2466 416.22818 371
2467 427.25843 258
2468 427.75239 140
2469 444.22073 193
2470 445.22144 158
2471 446.25750 1391 1+
2472 454.30766 803
2473 455.30621 262
2474 459.19230 240
2475 460.19626 319
2476 471.23733 152
2477 473.20061 147
2478 474.21970 130
2479 485.30693 793
2480 486.30083 226
2481 487.25595 126
2482 488.26706 362
2483 489.26016 167
2484 491.25650 185
2485 508.23735 424
2486 509.23373 164
2487 515.29074 287
2488 515.72025 1979
2489 516.22453 1257
2490 516.71930 4907 2+
2491 519.24442 144
2492 525.24603 172
2493 527.28073 274
2494 527.69691 259
2495 528.21625 162
2496 528.70633 187
2497 529.23967 173
2498 533.27623 187
2499 534.26933 187
2500 534.70604 166
2501 535.69639 151
2502 539.30626 462
2503 540.28703 210
2504 541.30146 140
2505 542.29249 151
2506 542.69324 183
2507 543.27533 183
2508 543.66892 189
2509 544.22596 752
2510 544.73614 564
2511 545.23236 867
2512 545.72746 495
2513 546.23172 339
2514 551.28867 179
2515 552.28315 151
2516 552.83226 141
2517 556.23017 160
2518 557.24148 212
2519 558.30390 186
2520 559.28375 285
2521 560.30217 415
2522 561.28925 897
2523 562.28872 288
2524 563.20123 195
2525 564.23065 176
2526 569.24360 307
2527 569.33229 327
2528 570.30881 192
2529 577.25345 143
2530 583.30708 183
2531 584.29094 138
2532 590.28869 132
2533 590.82281 174
2534 591.31871 234
2535 607.29493 145
2536 615.83496 351
2537 616.31880 640
2538 616.82671 381
2539 617.32017 188
2540 619.30235 137
2541 620.33443 134
2542 623.31968 211
2543 632.29400 218
2544 638.31041 151
2545 640.36116 295
2546 641.34644 179
2547 642.32819 174
2548 646.28503 128
2549 648.29188 174
2550 649.28936 171
2551 654.33102 275
2552 654.83147 131
2553 655.31711 133
2554 656.33441 185
2555 656.82885 211
2556 657.32834 179
2557 660.33375 131
2558 661.30604 173
2559 663.83857 154
2560 664.34775 165
2561 664.84740 183
2562 666.30888 141
2563 669.32101 142
2564 671.34832 142
2565 672.36385 999
2566 672.85969 2874 2+
2567 679.85625 143
2568 685.39706 160
2569 686.35236 129
2570 689.35615 303
2571 690.33128 396
2572 691.33750 223
2573 694.86291 131
2574 697.31596 156
2575 703.28298 134
2576 705.35313 155
2577 706.78811 150
2578 720.32112 129
2579 728.91280 165
2580 729.39424 351
2581 729.89165 205
2582 731.36743 374
2583 731.87715 194
2584 732.38136 183
2585 733.40566 190
2586 733.90751 247
2587 734.37980 301
2588 734.87659 221
2589 739.34746 147
2590 742.32875 226
2591 743.32439 212
2592 754.39992 183
2593 760.35838 219
2594 761.38280 131
2595 766.36918 152
2596 767.35346 219
2597 768.33131 170
2598 768.87453 219
2599 769.38318 289
2600 770.38507 126
2601 771.38019 170
2602 772.38888 132
2603 773.36652 128
2604 774.35926 128
2605 775.36036 145
2606 776.90718 4392 2+
2607 781.40646 250
2608 781.90517 275
2609 782.39808 537
2610 782.89912 374
2611 783.39609 649
2612 783.89687 2111 2+
2613 785.38190 2317
2614 785.92749 130631 2+
2615 788.40788 7141 2+
2616 788.71033 270
2617 789.74498 147
2618 791.37911 289
2619 791.46262 2779 1+
2620 791.90028 199
2621 805.32403 184
2622 806.35096 177
2623 817.42144 169
2624 818.43597 230
2625 853.47872 239
2626 854.48418 143
2627 922.02338 370
2628 922.53182 399
2629 923.01823 235
2630 923.51462 136
2631 931.48193 200
2632 932.47962 296
2633 1002.54104 204
2634 1003.51895 353
2635 1004.52692 168
2636 1011.52596 185
2637 1023.54982 536
2638 1024.07753 413
2639 1024.55582 229
2640 1025.06258 137
2641 1030.43772 227
2642 1031.45235 164
2643 1032.43133 448 1+
2644 1087.46268 204
2645 1088.45429 131
2646 1089.45738 238
2647 1090.44533 152
2648 1117.56496 312
2649 1118.54981 464
2650 1119.55553 234
2651 1125.09851 229
2652 1125.60116 254
2653 1126.09599 167
2654 1126.59405 281
2655 1230.65661 189
2656 1231.64088 314
2657 1232.67258 212
2658 END IONS
2659
2660 BEGIN IONS
2661 TITLE= Cmpd 1198, +MSn(1139.0413), 115.6 min
2662 PEPMASS=1139.04127 35714
2663 CHARGE=2+
2664 186.06697 101
2665 204.08122 658 1+
2666 218.15805 107
2667 243.13278 49
2668 244.14801 53
2669 246.22237 54
2670 251.14872 164 1+
2671 274.09103 57
2672 321.15376 58
2673 325.11619 49
2674 333.18005 293 1+
2675 339.22438 51
2676 349.23383 60
2677 350.19890 79
2678 357.25298 112
2679 361.18195 67
2680 363.21490 51
2681 366.15222 525
2682 386.22623 51
2683 403.21231 77
2684 407.16634 198
2685 411.21791 52
2686 414.21908 132 1+
2687 422.91091 53
2688 428.18724 63
2689 450.19182 55
2690 455.22002 60
2691 458.21991 58
2692 459.25228 57
2693 462.23993 134 1+
2694 464.22820 304 1+
2695 470.31991 74
2696 476.29331 53
2697 480.28262 83
2698 482.22868 52
2699 485.25041 65
2700 489.25799 153 1+
2701 492.24929 87
2702 506.26005 61
2703 516.27349 63
2704 517.29339 65
2705 519.28106 74
2706 527.24775 64
2707 528.21011 167
2708 530.22998 65
2709 531.27603 67
2710 533.26067 72
2711 536.28554 64
2712 538.26136 61
2713 546.29327 53
2714 547.27119 114
2715 556.27785 68
2716 558.27866 57
2717 567.32504 85
2718 569.31436 82
2719 573.33909 50
2720 575.29770 52
2721 577.31281 295 1+
2722 584.36969 64
2723 584.85450 50
2724 586.38917 58
2725 588.21636 74
2726 591.28306 52
2727 594.35884 56
2728 596.29058 131 1+
2729 601.34493 105
2730 603.76938 49
2731 608.32113 70
2732 610.30278 208 1+
2733 613.28983 84
2734 634.26092 57
2735 639.31798 76
2736 642.32708 127
2737 645.27320 61
2738 645.69784 58
2739 647.30985 51
2740 648.27876 66
2741 648.89845 53
2742 649.26542 88
2743 651.86457 99
2744 657.51323 54
2745 662.35531 61
2746 662.65258 67
2747 663.38722 68
2748 665.34001 63
2749 669.36545 72
2750 680.88636 56
2751 684.39273 58
2752 688.39727 74
2753 689.31390 85
2754 690.25527 54
2755 691.34634 66
2756 692.26103 50
2757 697.82582 63
2758 705.45498 56
2759 708.32745 431 1+
2760 715.86714 95
2761 720.86810 51
2762 723.31208 61
2763 723.81323 52
2764 724.33712 69
2765 725.38017 243 1+
2766 729.37254 67
2767 730.37981 58
2768 736.31255 60
2769 737.29632 56
2770 739.33837 151
2771 741.40356 53
2772 746.32342 52
2773 748.32907 55
2774 749.38571 55
2775 750.81507 50
2776 752.30818 66
2777 769.41580 69
2778 770.49326 53
2779 771.45780 138 1+
2780 784.46852 80
2781 787.39974 136
2782 788.88140 51
2783 791.37784 55
2784 794.33014 78
2785 797.91877 70
2786 804.41933 74
2787 807.92282 62
2788 812.49865 51
2789 817.93752 57
2790 818.33864 175 1+
2791 821.08182 51
2792 827.45839 220 1+
2793 829.42781 83
2794 829.99761 73
2795 831.45037 69
2796 832.37338 177 1+
2797 836.41444 153 1+
2798 839.99869 73
2799 849.84689 60
2800 850.43848 65
2801 851.77661 50
2802 853.46598 59
2803 874.71994 57
2804 879.45280 56
2805 882.78317 59
2806 883.12336 150 1+
2807 883.75565 64
2808 887.13603 74
2809 891.15961 62
2810 893.89203 66
2811 898.52515 53
2812 901.43356 83
2813 903.55364 53
2814 913.47898 52
2815 916.73700 49
2816 925.41887 53
2817 926.46277 58
2818 936.32494 51
2819 939.92914 51
2820 949.49739 82
2821 951.49325 81
2822 956.40132 57
2823 957.45010 98
2824 962.24731 54
2825 973.06172 53
2826 975.48281 61
2827 977.52036 53
2828 979.62809 64
2829 989.48089 54
2830 996.01011 66
2831 1000.55753 81
2832 1002.86138 59
2833 1003.50586 68
2834 1014.47728 51
2835 1018.53806 49
2836 1019.55891 54
2837 1024.48755 51
2838 1032.55672 98
2839 1047.47530 52
2840 1050.46109 52
2841 1050.77269 60
2842 1052.83591 57
2843 1054.49573 51
2844 1056.58009 51
2845 1060.22130 57
2846 1063.04664 60
2847 1065.98145 64
2848 1066.98258 79
2849 1067.45511 69
2850 1070.35707 64
2851 1070.52062 56
2852 1073.59406 92
2853 1078.54663 197 1+
2854 1078.96389 57
2855 1080.85322 49
2856 1085.51386 64
2857 1088.57092 61
2858 1093.26795 101
2859 1093.70242 60
2860 1101.69695 57
2861 1110.27813 89
2862 1111.57026 50
2863 1113.53491 76
2864 1116.30722 76
2865 1116.54939 54
2866 1119.72494 58
2867 1128.58448 53
2868 1130.57950 83
2869 1133.48916 52
2870 1133.72142 298 3+
2871 1135.36036 127
2872 1135.59531 406 3+
2873 1137.29030 918 3+
2874 1139.05306 12081 2+
2875 1142.39291 447 3+
2876 1143.59063 65
2877 1144.28433 213 3+
2878 1144.55008 243 2+
2879 1146.67923 614 2+
2880 1146.92036 64
2881 1164.81650 59
2882 1199.56811 71
2883 1208.58517 49
2884 1211.65642 56
2885 1241.74299 63
2886 1248.64072 54
2887 1314.55958 53
2888 1325.53523 50
2889 1339.03334 52
2890 1395.84822 50
2891 END IONS
2892
2893 BEGIN IONS
2894 TITLE= Cmpd 39, +MSn(594.3056), 25.0 min
2895 PEPMASS=594.30561 305807
2896 CHARGE=2+
2897 155.07260 370
2898 157.08131 359
2899 172.09849 1425
2900 173.11568 34216 1+
2901 175.10675 6062 1+
2902 182.08264 563
2903 183.07162 2004 1+
2904 187.12601 617
2905 199.09747 635
2906 200.09853 3198
2907 201.11542 21273 1+
2908 207.10960 419
2909 214.13234 479
2910 215.12585 750
2911 216.11441 475
2912 217.09836 406
2913 218.14316 2816 1+
2914 225.11889 479
2915 226.11063 2668 1+
2916 228.12474 700
2917 230.13364 454
2918 235.13190 514
2919 237.11938 534
2920 240.12798 791
2921 242.14698 3071 1+
2922 244.12150 5264 1+
2923 246.18023 948
2924 258.13947 697
2925 262.13190 401
2926 263.09532 1396 1+
2927 264.14388 303 2+
2928 265.12332 513
2929 270.12648 620
2930 270.15613 370
2931 271.16114 500
2932 284.14457 987
2933 285.14238 466
2934 288.20409 7748 1+
2935 294.15118 647
2936 296.16556 479
2937 297.14640 359
2938 298.18553 568
2939 301.18120 1275 2+
2940 302.17831 689
2941 303.20276 380
2942 311.16679 6143 1+
2943 315.13200 363
2944 316.15466 362
2945 327.16877 565
2946 329.18526 23732 1+
2947 330.68109 480
2948 337.16397 383
2949 339.20229 2271 1+
2950 341.18047 2266 2+
2951 342.18337 594
2952 343.68311 393
2953 344.17552 380
2954 345.18526 470
2955 355.18522 1281 2+
2956 357.20500 714
2957 359.19150 600
2958 360.18753 360
2959 363.14064 508
2960 363.26046 355
2961 365.19022 353
2962 368.67940 457
2963 372.19016 828
2964 373.17609 440
2965 377.18022 1788 2+
2966 381.15949 724
2967 382.20081 1059
2968 383.20685 1355 2+
2969 384.22315 369
2970 385.68938 2214 2+
2971 394.70134 2607 2+
2972 398.18489 659
2973 399.22256 959
2974 400.21637 5683 2+
2975 401.21611 2452 1+
2976 404.20953 672
2977 409.18611 518
2978 413.19654 729
2979 414.21862 447
2980 416.25743 12901 1+
2981 417.73347 348
2982 418.72812 474
2983 421.71371 1288 2+
2984 423.20185 364
2985 425.21557 922
2986 426.20436 1609 2+
2987 427.17854 590
2988 430.24063 718
2989 431.22210 464
2990 436.21111 350
2991 440.23661 1298 2+
2992 442.22951 657
2993 443.20590 665
2994 444.18576 565
2995 445.20705 581
2996 446.19154 383
2997 447.22207 362
2998 448.20763 441
2999 450.71396 393
3000 452.22415 421
3001 453.21480 384
3002 454.22561 432
3003 455.22439 383
3004 456.20716 400
3005 457.24598 444
3006 458.24891 1149 2+
3007 459.23277 613
3008 459.71180 789
3009 460.22859 378
3010 462.24950 380
3011 463.22934 402
3012 464.23731 430
3013 465.21664 353
3014 466.20663 657
3015 467.22883 370
3016 467.72048 358
3017 468.21687 3905 2+
3018 470.22986 512
3019 471.23230 428
3020 472.22468 599
3021 474.76332 2763 2+
3022 476.23076 15326 2+
3023 479.72812 387
3024 480.23730 521
3025 483.20727 631
3026 484.26505 2164 2+
3027 485.24504 96050 2+
3028 488.24202 5298 2+
3029 491.24359 543
3030 492.20198 406
3031 493.23262 606
3032 494.25107 36643 2+
3033 497.24317 390
3034 499.23986 646
3035 500.26657 516
3036 501.25474 941
3037 502.24559 502
3038 503.25559 527
3039 503.76630 539
3040 504.25425 646
3041 505.24740 452
3042 506.26772 584
3043 507.27004 487
3044 507.78313 454
3045 508.26819 397
3046 508.74891 486
3047 509.25266 6870 1+
3048 509.76626 2770 2+
3049 512.75556 499
3050 518.27365 4981 2+
3051 520.24517 757
3052 520.75119 403
3053 521.25528 737
3054 522.27197 482
3055 523.26037 364
3056 524.24324 371
3057 524.77877 368
3058 525.26031 437
3059 526.24910 396
3060 527.28049 3247 1+
3061 528.77335 422
3062 529.26629 4818 1+
3063 529.77100 372
3064 533.26445 2874 1+
3065 533.77631 691
3066 537.22154 763
3067 537.78046 2397 2+
3068 539.23420 542
3069 540.26810 440
3070 541.25115 499
3071 541.80892 392
3072 542.27525 4089 2+
3073 545.30145 16233 1+
3074 546.78991 7408 2+
3075 550.26461 417
3076 550.78809 4975 2+
3077 554.26389 687
3078 555.24201 5767 2+
3079 557.26358 563
3080 559.28509 575
3081 560.28295 539
3082 562.26627 660
3083 563.28366 747
3084 564.24960 438
3085 565.25716 589
3086 566.27302 489
3087 567.27094 545
3088 567.79343 536
3089 568.28013 837
3090 568.76860 372
3091 569.26537 462
3092 571.30038 6646 1+
3093 571.78325 382
3094 572.80705 364
3095 575.28924 790
3096 576.30239 881
3097 576.79594 982
3098 577.29036 3889 2+
3099 580.27482 424
3100 581.26732 397
3101 582.27981 471
3102 583.26186 504
3103 584.27539 459
3104 584.74780 358
3105 585.30195 2428
3106 585.79709 7112 2+
3107 587.29528 6747 1+
3108 587.80999 2661 1+
3109 591.80433 499
3110 592.31834 4893 1+
3111 592.81370 6251 2+
3112 593.80916 9898 1+
3113 594.31137 13305 1+
3114 594.81066 14243 2+
3115 596.32230 8965
3116 596.82180 5149
3117 597.33559 21633 2+
3118 600.31403 494
3119 601.35513 389 1+
3120 603.30872 567
3121 609.26881 367
3122 610.23976 460
3123 617.30320 451
3124 618.29392 415
3125 622.32074 552
3126 624.32035 354
3127 625.28949 985
3128 626.28892 739
3129 627.28680 413
3130 641.33462 520
3131 642.32238 4530 1+
3132 657.34846 570
3133 659.34988 31888 1+
3134 666.25121 809
3135 667.29244 419
3136 667.84246 483
3137 668.27956 422
3138 670.32403 617
3139 671.32880 464
3140 681.35367 848 1+
3141 683.27203 742
3142 684.28772 650
3143 685.31676 549
3144 689.32627 2191 1+
3145 701.31755 378
3146 703.37516 365
3147 709.36316 958 1+
3148 723.38692 772
3149 724.39818 416
3150 734.37650 8195 1+
3151 750.35647 355
3152 753.35317 2157 1+
3153 765.40643 479 1+
3154 770.37148 6038 1+
3155 788.39540 34576 1+
3156 796.35739 634
3157 797.36294 435
3158 798.38391 358
3159 799.42547 1847 1+
3160 817.42175 669
3161 824.38901 518
3162 835.43523 13389 1+
3163 841.41210 1003
3164 842.42014 2703 1+
3165 851.40145 1417 1+
3166 859.43440 63497 1+
3167 870.41049 371
3168 879.46594 221 1+
3169 915.49055 298 1+
3170 924.47921 507
3171 935.42647 228 1+
3172 946.46625 410
3173 948.51936 1656 1+
3174 951.45425 1416 1+
3175 967.52282 164 1+
3176 969.48201 1088
3177 970.46650 9289 1+
3178 987.49487 22927 1+
3179 1035.54003 1431 1+
3180 1074.55364 253 1+
3181 1092.57254 1966 1+
3182 END IONS
3183
3184 BEGIN IONS
3185 TITLE= Cmpd 758, +MSn(847.7508), 76.8 min
3186 PEPMASS=847.75082 94230
3187 CHARGE=3+
3188 159.09700 313 1+
3189 168.05036 130
3190 175.11292 112
3191 186.06662 935
3192 187.09653 1114 1+
3193 197.12168 91
3194 201.11125 240
3195 204.08160 3057 1+
3196 215.13024 392
3197 232.13991 1328 1+
3198 246.17938 227
3199 255.16823 227
3200 263.13894 185
3201 296.19250 90
3202 297.12633 71
3203 300.19229 2350 1+
3204 310.21264 974 1+
3205 314.21365 224
3206 315.14770 80
3207 319.17335 2255 1+
3208 325.18779 133
3209 328.22266 965 1+
3210 342.21243 91
3211 344.19066 657 1+
3212 349.14624 95
3213 351.21417 114
3214 357.16829 115
3215 358.15543 97
3216 359.23911 130
3217 364.19151 160
3218 366.15217 1263 2+
3219 367.13845 219 1+
3220 369.21394 1509 1+
3221 375.67188 362 2+
3222 387.22763 1953 1+
3223 399.29555 728 1+
3224 402.18285 78
3225 406.20943 2494 1+
3226 414.19179 118
3227 415.17863 120
3228 416.22978 107
3229 426.23826 182
3230 427.29482 2847 1+
3231 432.21888 1717 2+
3232 434.23685 81
3233 434.75693 67
3234 435.20819 85
3235 442.20645 73
3236 443.24244 97
3237 444.22861 77
3238 446.20748 73
3239 448.23347 161
3240 454.28599 344 1+
3241 458.23986 417 1+
3242 464.28256 823 1+
3243 469.77846 101
3244 471.26512 84
3245 472.31577 486 1+
3246 473.73008 317
3247 474.23425 417 2+
3248 480.25433 73
3249 482.27211 9386 2+
3250 485.32957 101
3251 486.25590 140
3252 489.23850 97
3253 492.25228 109
3254 500.30755 2672 1+
3255 504.21249 68
3256 507.25349 2280 1+
3257 519.24954 326 1+
3258 523.27116 395 2+
3259 524.32794 106
3260 525.35137 92
3261 526.80330 98
3262 527.27050 67
3263 529.35382 92
3264 530.23570 69
3265 531.23850 205
3266 532.27728 2789 2+
3267 537.27465 119
3268 539.31987 465 1+
3269 541.36294 527 1+
3270 545.26367 85
3271 549.27183 128
3272 550.27860 76
3273 555.30452 344 1+
3274 556.78393 137
3275 557.31677 1203 1+
3276 564.00416 68
3277 565.26602 401 2+
3278 573.28062 122
3279 575.29053 71
3280 577.29658 93
3281 585.28402 103
3282 594.28260 69
3283 594.80866 69
3284 595.27238 84
3285 599.34339 101
3286 601.32277 115
3287 602.80047 621 2+
3288 603.29456 807 1+
3289 604.79053 250 1+
3290 608.31844 80
3291 610.37484 392 2+
3292 612.26434 134
3293 613.80855 2640 2+
3294 621.29772 5499 1+
3295 628.31125 193
3296 628.84966 138
3297 630.27465 588 1+
3298 631.88057 5488 2+
3299 634.35540 100
3300 635.29617 94
3301 636.29789 138
3302 637.42391 365 1+
3303 639.83194 115
3304 640.84503 70
3305 641.84547 90
3306 642.31087 86
3307 643.32002 69
3308 644.31133 244 1+
3309 646.31028 126
3310 646.80552 330 2+
3311 648.34999 85
3312 650.36038 370 1+
3313 654.34574 112
3314 654.83937 104
3315 655.32208 68
3316 657.29872 101
3317 658.33118 1076 2+
3318 660.32718 88
3319 662.34618 122
3320 663.38129 76
3321 664.31574 599 1+
3322 666.84230 73
3323 668.36338 1162 1+
3324 672.31618 86
3325 676.25834 72
3326 677.83527 671 2+
3327 681.41010 339
3328 681.88693 905 2+
3329 686.37152 2234 1+
3330 687.60618 80
3331 690.31780 112
3332 694.27009 128
3333 695.29962 89
3334 696.33429 359 1+
3335 696.83865 81
3336 697.84470 255
3337 698.35048 350 1+
3338 702.36560 90
3339 703.37424 71
3340 705.31784 132
3341 706.35475 1492 2+
3342 709.40120 93
3343 709.87731 68
3344 710.43867 73
3345 712.87794 78
3346 716.34554 105
3347 717.36261 94
3348 721.86630 74
3349 722.33308 92
3350 724.91384 73
3351 725.86827 530 2+
3352 728.37847 138
3353 730.35050 496 2+
3354 731.29707 403 1+
3355 733.33993 586 1+
3356 735.85783 71
3357 736.34992 90
3358 737.88008 640 2+
3359 739.86173 3795 2+
3360 742.36274 308 3+
3361 744.34195 100
3362 746.37400 83
3363 746.83644 89
3364 747.35764 117
3365 748.36387 287 1+
3366 750.34270 7695 1+
3367 755.39332 71
3368 756.99518 68
3369 757.44801 71
3370 758.38195 104
3371 761.37260 76
3372 762.33091 99
3373 765.34277 356 1+
3374 767.42703 758 1+
3375 770.37279 691 2+
3376 773.39050 95
3377 774.37081 80
3378 775.32015 104
3379 775.89700 126
3380 776.35399 96
3381 777.34084 67
3382 779.57250 86
3383 779.73079 643 3+
3384 780.90649 86
3385 781.39570 191
3386 783.37114 77
3387 784.40199 91
3388 785.44258 2029 1+
3389 786.03245 121
3390 788.90739 97
3391 789.39855 4476 2+
3392 793.36616 766 1+
3393 794.91777 116
3394 798.39652 129
3395 800.40499 84
3396 803.40058 77
3397 804.36672 78
3398 805.37900 429 2+
3399 809.10307 70
3400 810.41397 102
3401 812.44384 80
3402 814.38455 1393 2+
3403 816.06405 182
3404 816.36349 589 1+
3405 817.89564 87
3406 821.39154 104
3407 822.41111 92
3408 823.02182 889 2+
3409 826.41311 83
3410 827.40720 309 1+
3411 828.92521 67
3412 830.40290 89
3413 830.91194 1256 2+
3414 835.49959 880 2+
3415 836.75294 93
3416 838.33842 76
3417 839.92157 2035 2+
3418 841.20991 126
3419 841.42113 3356 3+
3420 843.94609 400
3421 844.15898 159
3422 844.45825 576
3423 845.02468 18134 2+
3424 846.92646 6004 2+
3425 847.08020 5094 3+
3426 849.91905 602 2+
3427 850.67552 110
3428 850.89755 1002 2+
3429 851.05678 129
3430 853.02850 97
3431 853.45078 873 3+
3432 860.38742 76
3433 861.41004 96
3434 863.43049 2918 1+
3435 867.45822 129
3436 868.48837 114
3437 869.45627 71
3438 869.92364 138
3439 870.44458 121
3440 878.91499 1345 2+
3441 883.45853 72
3442 887.45666 2447 2+
3443 890.42162 81
3444 892.40330 478 1+
3445 896.47105 412 1+
3446 896.95962 75
3447 905.43132 88
3448 914.49110 1124 1+
3449 919.47847 113
3450 919.90997 67
3451 920.46022 104
3452 928.45381 848 2+
3453 938.57093 562 1+
3454 946.44946 153
3455 947.46122 339 1+
3456 960.97469 610 2+
3457 964.47770 5093 1+
3458 975.49563 76
3459 979.44171 182
3460 981.42885 66
3461 983.52455 76
3462 990.53923 91
3463 992.95832 90
3464 993.45691 133
3465 994.41994 77
3466 1001.51410 309 1+
3467 1007.46911 84
3468 1012.47488 591 2+
3469 1018.49498 81
3470 1021.48017 1800 2+
3471 1046.52402 81
3472 1052.62088 101
3473 1053.61564 97
3474 1063.54729 1236 1+
3475 1068.59293 70
3476 1069.01146 133
3477 1069.53658 107
3478 1070.04856 92
3479 1078.02585 102
3480 1078.48073 303
3481 1079.49522 99
3482 1104.06121 72
3483 1112.53879 456 2+
3484 1121.56090 519 2+
3485 1129.52476 406 1+
3486 1161.48401 68
3487 1179.56448 81
3488 1226.62336 174
3489 1227.64652 133
3490 1262.75386 678 1+
3491 1315.65509 379 1+
3492 1478.66696 86
3493 1578.82302 81
3494 END IONS
3495
3496 BEGIN IONS
3497 TITLE= Cmpd 871, +MSn(724.3762), 88.9 min
3498 PEPMASS=724.37624 328342
3499 CHARGE=2+
3500 157.08314 305
3501 172.05889 494
3502 175.10619 2202 1+
3503 183.10668 243
3504 200.12971 2149 1+
3505 215.12797 128
3506 225.15331 112
3507 226.10339 135
3508 228.13063 2059 1+
3509 240.12603 445 1+
3510 243.13826 1113 1+
3511 253.12391 131
3512 257.15957 494 1+
3513 259.09490 138
3514 262.10277 89
3515 268.13786 164
3516 271.14039 16948 1+
3517 285.15511 1470 1+
3518 288.20588 3023 1+
3519 295.13308 206
3520 312.14245 101
3521 313.15998 213
3522 314.67763 108
3523 322.15223 94
3524 323.16279 124
3525 325.68298 79
3526 327.19691 83
3527 329.16807 93
3528 331.18154 86
3529 337.16563 187
3530 339.19584 1174 1+
3531 351.16836 147
3532 355.16626 315
3533 356.22896 8508 1+
3534 366.21371 124
3535 367.20551 251
3536 368.20766 194
3537 369.17810 626 1+
3538 372.18512 247
3539 373.19632 88
3540 375.22965 110
3541 382.17280 580 1+
3542 384.22489 6433 1+
3543 388.13366 199
3544 392.19258 90
3545 396.19026 129
3546 397.17563 1214 1+
3547 400.18685 592 1+
3548 405.20037 95
3549 414.20692 1714 1+
3550 422.18301 106
3551 424.19587 86
3552 425.15920 107
3553 435.27417 8198 1+
3554 440.25540 167
3555 441.21234 83
3556 442.20086 137
3557 443.25607 100
3558 448.21454 84
3559 449.19964 101
3560 450.23086 1495 1+
3561 456.23658 77
3562 457.20935 116
3563 458.23316 122
3564 467.24851 279
3565 468.24218 2714 1+
3566 472.26093 125
3567 474.25025 104
3568 476.24304 80
3569 477.24110 118
3570 478.23598 905 1+
3571 483.22357 158
3572 484.20539 100
3573 485.26381 2742 1+
3574 489.17415 76
3575 493.24394 81
3576 495.25827 1157
3577 496.24377 4159 1+
3578 501.22254 271
3579 502.21656 196
3580 503.29529 133
3581 504.24928 77
3582 508.23306 145
3583 509.21350 99
3584 511.20965 126
3585 512.18999 124
3586 513.26849 6118 1+
3587 518.27187 80
3588 523.76861 447 2+
3589 525.21847 175
3590 526.21456 749 1+
3591 529.23866 178
3592 530.25359 150
3593 532.78003 110
3594 533.25695 121
3595 534.26026 91
3596 541.26304 83
3597 542.79647 95
3598 543.24729 670 1+
3599 545.30455 100
3600 546.31010 277
3601 546.78088 79
3602 547.30481 130
3603 551.29435 82
3604 552.25418 93
3605 553.32840 94
3606 562.26074 90
3607 563.22806 82
3608 564.31560 9723 1+
3609 571.27726 140
3610 571.82007 89
3611 572.29592 120
3612 573.25866 101
3613 574.30467 108
3614 579.27744 255
3615 580.28677 997 2+
3616 582.28546 111
3617 585.32528 91
3618 586.29071 117
3619 589.31427 2223 2+
3620 593.29327 100
3621 594.29389 190
3622 595.28461 86
3623 596.28177 208
3624 597.28436 329
3625 598.28197 207
3626 599.27435 174
3627 600.27368 93
3628 602.33977 98
3629 606.28067 100
3630 607.28286 289
3631 608.28034 123
3632 609.27849 135
3633 612.27743 149
3634 614.29436 1053 1+
3635 620.29377 86
3636 620.77711 78
3637 624.29938 576
3638 625.28976 1731 1+
3639 628.32618 259
3640 628.86183 97
3641 629.31868 198
3642 629.83228 144
3643 630.26173 99
3644 633.29090 78
3645 637.31987 1295 2+
3646 640.31202 80
3647 642.31231 2488 1+
3648 642.84105 86
3649 646.33133 3873 2+
3650 650.37071 602 1+
3651 651.83272 91
3652 653.27394 116
3653 655.26276 496 1+
3654 657.32835 290
3655 657.81171 246
3656 658.32482 133
3657 659.29234 110
3658 660.30067 112
3659 665.82264 256
3660 666.32692 686 2+
3661 671.31385 120
3662 672.27559 337
3663 673.29324 185
3664 673.87329 85
3665 674.29682 101
3666 674.84841 1792 2+
3667 677.39909 7208 1+
3668 688.38949 106
3669 689.37074 88
3670 693.32010 123
3671 694.31392 111
3672 697.85252 105
3673 698.35525 222
3674 701.36334 140
3675 701.88413 91
3676 702.32190 123
3677 705.39132 116
3678 705.85032 108
3679 706.35729 1394 2+
3680 710.35737 87
3681 712.33750 105
3682 713.29571 84
3683 715.36965 11248 2+
3684 720.86067 81
3685 721.40555 157
3686 721.94921 115
3687 723.22442 119
3688 723.38924 201
3689 723.69699 153
3690 723.84124 88
3691 724.38216 40703 2+
3692 725.65558 122
3693 727.37398 284
3694 727.87047 190
3695 728.35316 221
3696 728.86836 81
3697 729.37819 244
3698 736.32899 250
3699 738.38350 112
3700 739.33298 84
3701 743.36555 297
3702 744.33875 154
3703 750.30669 101
3704 751.35070 95
3705 753.33584 173
3706 754.33911 1488 1+
3707 762.34613 82
3708 764.37931 88
3709 765.40329 87
3710 768.38075 164
3711 769.35582 132
3712 771.35662 1502 1+
3713 785.36579 243
3714 786.38534 114
3715 788.42372 279
3716 789.43438 123
3717 800.34898 84
3718 806.44517 7862 1+
3719 816.41566 93
3720 839.41244 199
3721 840.38992 83
3722 849.44197 110
3723 856.45505 163
3724 857.41577 153
3725 866.42923 155
3726 867.42866 800 1+
3727 884.45353 812 1+
3728 898.39476 108
3729 899.41502 80
3730 914.44725 131
3731 917.47822 863 1+
3732 935.48960 11936 1+
3733 968.47765 85
3734 978.46886 84
3735 996.46876 199
3736 997.45259 125
3737 1013.48970 904 1+
3738 1046.52995 919 1+
3739 1062.57318 81
3740 1063.50997 88
3741 1064.53502 10520 1+
3742 1074.52569 319
3743 1075.53327 99
3744 1076.50429 81
3745 1143.57033 83
3746 1159.56625 414 1+
3747 1175.57101 81
3748 1177.62127 1761 1+
3749 1187.59795 111
3750 1188.63859 112
3751 1273.60337 112
3752 1274.67063 115
3753 1291.67111 166
3754 1292.73473 135
3755 1348.68955 562 1+
3756 END IONS
3757
3758 BEGIN IONS
3759 TITLE= Cmpd 752, +MSn(697.6842), 76.3 min
3760 PEPMASS=697.68418 239817
3761 CHARGE=3+
3762 172.06169 105
3763 173.11520 1101 1+
3764 183.10086 280
3765 186.07803 106
3766 187.13299 256
3767 197.12054 132
3768 199.17335 4051 1+
3769 201.11523 3105 1+
3770 215.13440 475
3771 217.09140 191
3772 226.11987 99
3773 227.17252 3854 1+
3774 229.12171 442
3775 233.13677 99
3776 234.12212 1875 1+
3777 237.12252 139
3778 243.11570 310 1+
3779 245.09338 254 1+
3780 246.15997 132
3781 247.08480 86
3782 249.14457 125
3783 260.19489 397 1+
3784 262.12043 2026 1+
3785 267.13338 212
3786 268.19185 255 1+
3787 274.12231 110
3788 277.13775 94
3789 278.14844 172
3790 283.15571 556 1+
3791 286.20727 87
3792 287.14367 599 1+
3793 291.14205 1198 1+
3794 294.07460 93
3795 296.19623 4218 1+
3796 302.11752 208
3797 302.16947 691 1+
3798 310.19147 85
3799 311.16395 108
3800 312.14714 109
3801 313.16938 94
3802 314.20294 1088 1+
3803 315.17812 88
3804 319.14507 2754 1+
3805 323.17977 146
3806 328.18794 337 1+
3807 330.15620 157
3808 334.69283 424 2+
3809 340.22605 1166 1+
3810 345.15302 78
3811 346.17957 89
3812 347.20543 431 1+
3813 348.15914 110
3814 354.18512 83
3815 356.18819 463 1+
3816 358.17446 657 1+
3817 361.19613 85
3818 362.19439 314 1+
3819 366.17447 88
3820 367.19188 353 1+
3821 370.24472 83
3822 371.23432 101
3823 374.23057 102
3824 375.20936 1645 1+
3825 380.22444 165
3826 381.19781 111
3827 385.20658 544 1+
3828 387.25476 357 1+
3829 392.21020 483 2+
3830 394.18230 150
3831 397.24643 735 1+
3832 400.20911 146
3833 403.21642 270 1+
3834 407.25870 119
3835 410.21531 144
3836 414.21501 130
3837 415.19418 381 1+
3838 415.25622 2132 1+
3839 418.24238 751 1+
3840 422.18731 116
3841 423.20286 89
3842 424.23044 112
3843 425.22979 155
3844 430.21362 130
3845 431.22714 130
3846 432.22785 1663 1+
3847 440.20064 133
3848 441.23664 172
3849 442.22103 111
3850 444.27636 143
3851 451.24752 152
3852 452.27025 119
3853 453.26925 79
3854 454.21886 94
3855 455.28399 457 1+
3856 456.73248 866 2+
3857 457.23481 1265 1+
3858 462.27246 203
3859 462.76966 287 2+
3860 464.21202 86
3861 465.28817 438 2+
3862 468.23532 121
3863 469.27660 344 1+
3864 471.24957 706 1+
3865 474.24830 139
3866 476.25109 1060 1+
3867 479.24119 166
3868 480.26245 1516 1+
3869 487.32391 212
3870 488.28049 556 1+
3871 491.26747 171
3872 492.24918 110
3873 495.22374 140
3874 497.24480 122
3875 498.28516 1789 1+
3876 503.26391 142
3877 504.26959 121
3878 505.27628 130
3879 506.22912 80
3880 509.24892 144
3881 510.25669 103
3882 511.26708 408 2+
3883 513.28990 1312 2+
3884 515.26296 264
3885 516.28051 1560 1+
3886 522.25070 106
3887 523.26143 82
3888 525.90001 109
3889 526.28662 107
3890 527.26697 101
3891 527.79569 256
3892 528.29214 209
3893 528.76969 148 2+
3894 530.26755 392 1+
3895 533.27855 1373 1+
3896 537.28645 144
3897 538.29217 85
3898 538.77291 95
3899 539.30102 153
3900 544.28922 83
3901 548.26814 546 1+
3902 551.22073 133
3903 553.27459 366 1+
3904 553.59871 342 3+
3905 555.29846 1399 1+
3906 556.80529 181
3907 559.59709 141
3908 559.94160 142
3909 560.28809 659 1+
3910 560.81365 98
3911 565.24319 80
3912 566.29606 486 1+
3913 567.79645 85
3914 569.29643 133
3915 569.83398 1798 2+
3916 572.25431 82
3917 574.28373 90
3918 575.33706 109
3919 576.29855 151
3920 577.29962 101
3921 577.79678 1432 2+
3922 580.28852 91
3923 581.27768 167
3924 581.63842 88
3925 581.95395 82
3926 584.32476 439
3927 585.31461 1377 2+
3928 587.29660 448 3+
3929 588.29723 154
3930 589.30700 102
3931 590.27400 107
3932 591.31247 113
3933 593.28710 1171 3+
3934 597.31013 90
3935 599.33428 79
3936 601.38704 100
3937 602.32200 112
3938 603.83803 111
3939 604.32215 119
3940 604.79970 87
3941 605.29579 820 1+
3942 610.30374 82
3943 610.62766 96
3944 611.29177 82
3945 613.32017 100
3946 615.80408 101
3947 616.32052 425 1+
3948 618.97356 1339 3+
3949 620.31459 138
3950 621.30275 152
3951 623.29686 411 1+
3952 624.97505 902 3+
3953 626.33811 659 1+
3954 626.87988 141
3955 630.98081 5889 3+
3956 633.30856 683 2+
3957 637.30495 125
3958 639.27881 98
3959 641.31666 100
3960 641.84567 320
3961 642.33220 3353 2+
3962 647.31348 112
3963 647.97516 113
3964 648.35221 680 2+
3965 651.33614 89
3966 652.26699 152
3967 653.30573 149
3968 653.98600 500 3+
3969 659.29488 110
3970 659.99419 949 3+
3971 661.33733 1154 1+
3972 666.34005 143
3973 667.30172 99
3974 668.37838 568 1+
3975 671.35656 114
3976 672.34550 91
3977 673.34082 102
3978 677.35290 490 1+
3979 677.84854 90
3980 679.36280 253
3981 680.34027 891 1+
3982 682.88614 102
3983 683.34182 490 2+
3984 685.68067 2427 3+
3985 687.32887 129
3986 688.39373 121
3987 688.84794 108
3988 689.29191 83
3989 689.37156 118
3990 689.84583 146
3991 690.33330 107
3992 691.35141 4775 3+
3993 691.86391 2008 2+
3994 694.46084 649 4+
3995 695.40759 284
3996 695.79678 81
3997 696.37862 502 4+
3998 696.98237 112
3999 697.38101 1547
4000 697.68971 31313 3+
4001 698.69560 5252 6+
4002 699.89264 423
4003 700.39323 13694 2+
4004 703.35669 162
4005 703.72590 157
4006 704.06968 147
4007 704.38587 93
4008 706.84414 3999 2+
4009 709.36712 80
4010 716.32431 79
4011 717.38367 107
4012 718.37872 96
4013 720.44721 82
4014 721.40529 81
4015 726.93469 98
4016 737.33850 128
4017 738.38020 81
4018 744.38706 92
4019 751.32711 106
4020 753.29449 105
4021 761.37956 92
4022 765.36157 78
4023 774.36212 79
4024 775.35811 78
4025 777.45364 1106 1+
4026 783.41312 500 1+
4027 788.37714 6312 2+
4028 791.38767 88
4029 794.94331 106
4030 795.41140 128
4031 798.33857 86
4032 800.45171 84
4033 804.39842 467 1+
4034 809.42398 102
4035 811.41130 81
4036 812.44322 926 1+
4037 817.41542 119
4038 820.94408 589 2+
4039 824.39721 92
4040 829.39275 440 2+
4041 838.90118 5968 2+
4042 858.43193 99
4043 865.43832 113
4044 866.39690 96
4045 867.02139 107
4046 871.43245 155
4047 871.91286 88
4048 876.40030 80
4049 877.48910 132
4050 877.99536 169
4051 878.48106 96
4052 879.48246 168
4053 880.44126 450 2+
4054 882.45614 84
4055 888.51197 98
4056 889.42701 8146 2+
4057 892.41765 129
4058 910.40886 136
4059 912.45769 654 1+
4060 924.53203 667 1+
4061 929.56906 200 1+
4062 937.45308 80
4063 941.49062 887 1+
4064 945.96758 2934 2+
4065 980.47536 244 2+
4066 989.48765 2756 2+
4067 993.50160 104
4068 1025.57253 1061 1+
4069 1056.53210 992 1+
4070 1138.66069 423 1+
4071 1169.62194 1553 1+
4072 END IONS
4073
4074 BEGIN IONS
4075 TITLE= Cmpd 75, +MSn(641.8547), 26.7 min
4076 PEPMASS=641.85466 516186
4077 CHARGE=2+
4078 157.07624 504
4079 169.11566 1571 1+
4080 175.06196 2426 1+
4081 183.10960 407
4082 185.08194 1727 1+
4083 191.10915 714
4084 197.12157 1272 1+
4085 199.17393 38017 1+
4086 199.49184 254 5+
4087 201.11310 1949 1+
4088 213.09429 4694 1+
4089 218.14657 476
4090 219.10785 1286 2+
4091 224.10532 473
4092 226.14638 449
4093 227.17242 22606 1+
4094 230.11076 2916 1+
4095 242.11333 1221 1+
4096 244.11376 649
4097 246.62952 410 2+
4098 251.14472 464
4099 254.13919 868
4100 255.14584 3315 1+
4101 255.64103 660
4102 260.19164 4404 1+
4103 262.12436 416
4104 266.15755 593
4105 269.14171 2829 2+
4106 272.15992 704
4107 282.14332 370
4108 283.17302 581
4109 284.16802 6169 1+
4110 296.19843 3534 1+
4111 298.15741 487 2+
4112 300.13958 593
4113 306.64018 1389 2+
4114 311.17251 12109 1+
4115 314.20919 7856 1+
4116 319.19496 762
4117 320.17577 228 2+
4118 324.12594 399
4119 325.16950 686 2+
4120 326.16170 3983 2+
4121 328.19437 379
4122 329.15031 2012 1+
4123 332.19902 925
4124 333.18143 725
4125 333.68090 467 2+
4126 337.19159 376
4127 339.23928 514
4128 340.17097 549
4129 341.15417 14744 1+
4130 342.67374 1380 1+
4131 345.20865 551
4132 347.16596 880
4133 349.22558 739
4134 355.19281 5565 1+
4135 356.17685 3052 2+
4136 360.19390 701
4137 364.17097 405
4138 367.22792 4750 3+
4139 368.20495 2261 1+
4140 368.68755 2076 2+
4141 371.19935 437
4142 371.65503 468
4143 373.20319 2376 2+
4144 374.20339 467
4145 375.22666 549
4146 382.16992 366
4147 382.70284 6189 2+
4148 385.22042 2114 2+
4149 386.23753 627
4150 387.16298 710
4151 390.20111 1137 2+
4152 395.20432 368
4153 396.24447 4437 1+
4154 404.18165 1404
4155 404.68968 890 2+
4156 406.20532 395
4157 407.19474 438
4158 409.26412 369
4159 411.19081 385
4160 413.20233 2642 2+
4161 414.23242 686
4162 415.23964 472
4163 416.21488 445
4164 417.22503 379
4165 421.19791 440
4166 422.21208 722
4167 423.22015 839
4168 424.24584 7494 1+
4169 428.19195 1370 2+
4170 431.22850 510
4171 431.71771 520
4172 432.23086 553
4173 433.23482 1221 2+
4174 434.23636 403
4175 437.20843 3178 1+
4176 438.20819 1642 2+
4177 440.71403 2242 2+
4178 442.23523 3311 1+
4179 444.18553 1723 1+
4180 445.71575 6553 2+
4181 448.20515 363
4182 449.22031 525
4183 449.73815 7578 2+
4184 451.22004 928
4185 452.21477 701
4186 454.22064 546
4187 455.22261 589
4188 456.21463 701
4189 457.21901 362
4190 458.29687 1500
4191 458.75397 3075 2+
4192 460.23207 2447 2+
4193 461.22805 839
4194 462.19420 387
4195 463.26602 474
4196 466.23827 545
4197 467.23573 680
4198 467.76841 4953 2+
4199 469.24184 814
4200 469.73831 1550 2+
4201 471.23700 414
4202 472.24170 539
4203 473.24077 1314 2+
4204 474.22800 3663 2+
4205 476.25578 930
4206 477.23960 619
4207 479.20335 1119
4208 480.22288 7198 2+
4209 483.22169 363
4210 485.25498 5076 2+
4211 486.27516 5424 1+
4212 489.23538 72180 2+
4213 492.25176 2048 1+
4214 494.24538 36799 2+
4215 497.21870 4347 2+
4216 498.21635 2169 1+
4217 501.23246 416
4218 502.23902 528
4219 503.23752 414
4220 504.24771 473
4221 505.23859 3115 1+
4222 509.26598 1070
4223 510.26960 18596 1+
4224 510.75566 2120 1+
4225 514.24945 432
4226 515.21792 11022 1+
4227 519.25945 926
4228 519.76502 10283 2+
4229 524.26529 441
4230 525.23856 464
4231 528.29530 831
4232 528.77420 45394 2+
4233 532.27861 851
4234 532.78954 417
4235 533.27907 728
4236 533.76615 801
4237 534.28621 6724 1+
4238 536.76590 476
4239 537.27615 8844 1+
4240 544.25574 395
4241 544.77159 427
4242 545.27401 982
4243 545.77630 4150 2+
4244 547.27362 766
4245 549.31450 588
4246 550.33824 1112 2+
4247 552.30285 644
4248 553.27816 28247 2+
4249 555.29953 6522 1+
4250 556.78286 482
4251 561.27325 543
4252 563.27766 625
4253 564.28329 575
4254 565.26265 536
4255 567.25553 659
4256 567.80182 401
4257 568.26389 382
4258 569.27911 1535 3+
4259 570.27426 588
4260 572.27885 634
4261 573.32166 3098 1+
4262 574.95207 2492 3+
4263 576.28965 3715 1+
4264 576.80779 787
4265 579.29385 2574 1+
4266 580.79998 447
4267 581.29486 3695 2+
4268 583.28839 689
4269 584.27765 531
4270 585.31465 11743 2+
4271 588.30914 3578 2+
4272 589.80859 12768
4273 590.30613 57032 2+
4274 593.27881 405
4275 594.26871 629
4276 595.30754 1882 1+
4277 597.30307 24326 1+
4278 602.33404 508
4279 606.29724 2803 1+
4280 611.31760 545
4281 612.27308 2710 1+
4282 615.28992 737
4283 616.28188 367
4284 617.28413 616
4285 618.31389 725
4286 619.32575 614
4287 620.30929 672
4288 621.30659 613
4289 622.31126 403
4290 623.31594 976
4291 623.83182 5789 2+
4292 624.32317 4908 1+
4293 629.27600 613
4294 630.29943 753
4295 631.30444 754
4296 631.83725 368
4297 632.32837 823
4298 632.84408 16883 2+
4299 635.30491 2425 1+
4300 638.32542 819
4301 638.82793 914
4302 639.34426 9000 1+
4303 639.83616 539
4304 640.35104 11701 2+
4305 641.61829 959
4306 641.85719 119893 2+
4307 644.83985 3152 1+
4308 645.36120 9421 1+
4309 649.33173 2821 1+
4310 651.31612 14766 1+
4311 658.38079 425
4312 659.27157 620
4313 660.33609 531
4314 666.35452 2370 1+
4315 668.36700 3869 1+
4316 673.26874 364
4317 675.32476 657
4318 676.33051 972
4319 677.32626 394
4320 679.31058 385
4321 683.32704 387
4322 686.40161 782
4323 687.38918 389
4324 689.33014 383
4325 690.33663 514
4326 692.36213 889
4327 693.33450 870
4328 694.31299 428
4329 698.32379 385
4330 700.85795 3593 2+
4331 710.37423 12201 1+
4332 714.34801 673
4333 715.33494 394
4334 716.30650 531
4335 717.31850 443
4336 719.35375 467
4337 720.36126 373
4338 730.35836 413
4339 731.35946 393
4340 732.33882 388
4341 734.34192 383
4342 736.36783 4441 1+
4343 742.30941 532
4344 743.29953 506
4345 745.39911 607 1+
4346 747.37057 2510 1+
4347 752.33746 472
4348 755.43332 920
4349 756.40011 567
4350 760.33313 493
4351 762.35763 485
4352 763.37134 477
4353 764.39840 8590 1+
4354 769.43357 1219 1+
4355 773.41811 800
4356 775.38564 376
4357 779.39494 2657 1+
4358 789.35817 670
4359 790.36410 709
4360 791.34341 491
4361 793.37455 8998 1+
4362 797.41609 17668 1+
4363 805.37677 476
4364 806.39095 429
4365 807.36669 1889
4366 808.37209 4467 1+
4367 813.34479 548
4368 814.34714 485
4369 823.39804 550
4370 824.41104 394
4371 825.38234 10991 1+
4372 831.34264 782
4373 832.35975 474
4374 846.37175 657
4375 847.36180 886
4376 848.37281 544
4377 849.36982 482
4378 850.38276 362
4379 851.40764 390
4380 853.41503 264 2+
4381 855.37663 270 1+
4382 862.40882 888
4383 863.38469 407
4384 865.46237 153 1+
4385 870.93624 362
4386 875.40910 603 1+
4387 880.42079 11305 1+
4388 890.42423 7821 1+
4389 896.44752 546
4390 898.46903 15351 1+
4391 903.42450 570
4392 904.41634 509
4393 910.45080 668
4394 911.44299 462
4395 916.50067 876 1+
4396 919.45687 1417 1+
4397 921.43924 2526 1+
4398 928.47151 399
4399 929.47253 444
4400 934.52955 449 1+
4401 938.46935 4794 1+
4402 941.49094 617
4403 942.49672 419
4404 943.52599 581
4405 945.47427 178 1+
4406 947.44872 1597 1+
4407 959.43849 4113 1+
4408 969.50269 6466 1+
4409 977.46349 24398 1+
4410 987.48348 4937 1+
4411 993.43012 567 1+
4412 1038.52276 2206 1+
4413 1056.54113 28139 1+
4414 1090.54532 406 1+
4415 1105.54904 3279 1+
4416 END IONS
4417
4418 BEGIN IONS
4419 TITLE= Cmpd 220, +MSn(824.3852), 36.3 min
4420 PEPMASS=824.38516 93979
4421 CHARGE=3+
4422 175.10603 144
4423 186.06797 237
4424 204.08069 1047 1+
4425 208.07612 122
4426 225.09599 2140 1+
4427 289.15373 182
4428 289.18597 127
4429 303.18256 272
4430 324.17207 3448 1+
4431 343.19459 181
4432 364.18129 141
4433 366.15431 291
4434 367.15241 142
4435 377.19898 144
4436 378.18675 185
4437 379.18941 124
4438 395.24626 122
4439 406.17366 330
4440 407.17571 129
4441 419.22323 181
4442 422.71534 116
4443 423.24182 1876 1+
4444 426.23163 349
4445 427.23466 153
4446 433.21038 122
4447 436.26241 150
4448 445.27837 134
4449 462.26309 379
4450 466.23555 331
4451 467.24959 117
4452 472.25073 405
4453 475.20477 125
4454 480.26252 495
4455 481.25883 263
4456 487.23688 168
4457 490.27250 2818 2+
4458 491.26680 1055 1+
4459 493.22126 486
4460 511.25082 177
4461 514.30309 209
4462 515.71782 511
4463 516.22314 269
4464 516.71982 1251 2+
4465 518.30028 174
4466 519.25517 209
4467 532.29662 148
4468 539.31135 219
4469 542.20764 136
4470 543.73512 144
4471 544.23563 2589
4472 544.73112 1704
4473 545.22856 6262 2+
4474 551.29209 2160 1+
4475 552.82195 183
4476 555.26334 144
4477 556.21353 360
4478 556.70245 159
4479 557.22977 228
4480 560.29186 153
4481 560.80250 416
4482 561.29989 353
4483 562.26489 289
4484 563.24368 244
4485 564.22308 182
4486 570.21077 130
4487 571.20278 273
4488 572.20918 238
4489 572.69248 169
4490 575.34746 488
4491 576.34948 221
4492 580.27684 1760 1+
4493 581.76530 126
4494 584.27461 126
4495 585.33267 1225 1+
4496 589.29202 124
4497 596.32598 169
4498 602.36224 148
4499 603.35252 5958 1+
4500 608.31005 202
4501 609.31293 366
4502 613.80774 458
4503 614.31245 323
4504 616.28724 147
4505 618.31807 153
4506 618.77762 174
4507 619.29575 216
4508 620.38031 15377 1+
4509 620.78184 121
4510 621.79834 143
4511 624.80630 281
4512 625.30598 209
4513 625.79796 445
4514 626.32532 409
4515 626.79601 127
4516 627.32041 177
4517 627.78978 215
4518 628.28187 155
4519 631.84006 155
4520 632.80341 172
4521 637.27931 135
4522 638.29882 135
4523 638.97394 167
4524 642.32773 170
4525 652.81685 199
4526 653.30546 125
4527 654.32980 156
4528 655.30323 163
4529 656.84103 123
4530 671.31868 118
4531 672.33663 147
4532 672.84189 130
4533 679.29364 128
4534 681.31277 161
4535 681.80981 240
4536 682.31086 157
4537 688.33030 136
4538 689.30116 121
4539 690.88717 158
4540 691.39544 189
4541 691.91885 139
4542 693.36432 1269 1+
4543 698.34307 152
4544 700.38317 151
4545 706.30471 156
4546 717.33664 134
4547 721.40401 1319 1+
4548 721.93205 262
4549 724.30071 168
4550 725.31998 177
4551 732.35527 157
4552 745.64721 122
4553 749.30513 128
4554 751.40313 169
4555 757.38700 243
4556 757.88154 169
4557 758.37908 156
4558 758.91246 147
4559 759.37044 144
4560 763.39852 124
4561 765.30925 153
4562 767.36146 133
4563 767.90065 156
4564 769.39086 127
4565 770.36085 159
4566 771.38810 133
4567 771.86371 326
4568 772.35607 295
4569 772.86434 216
4570 773.38812 171
4571 773.88035 117
4572 774.93547 120
4573 776.38252 152
4574 777.31586 346
4575 778.43304 327
4576 779.40731 157
4577 790.33959 119
4578 790.86182 131
4579 791.36655 160
4580 792.35201 131
4581 795.33185 386
4582 796.36017 249
4583 796.71194 164
4584 803.34704 143
4585 805.31364 162
4586 809.40866 127
4587 810.36775 138
4588 811.34958 140
4589 811.90696 127
4590 812.38996 149
4591 813.39108 154
4592 814.85811 122
4593 815.38319 231
4594 817.34057 145
4595 817.76869 141
4596 818.05884 118
4597 818.39302 2549 3+
4598 820.41444 2934 2+
4599 821.92359 19723 2+
4600 824.39481 99594 3+
4601 826.74129 1007
4602 826.95686 188
4603 827.48938 2118 3+
4604 827.95210 3364 2+
4605 829.41042 33670 2+
4606 831.15118 195
4607 832.37626 143
4608 844.40622 261
4609 845.37653 164
4610 847.40092 128
4611 847.89196 134
4612 857.89439 126
4613 863.48805 457
4614 864.45429 233
4615 875.88445 346
4616 876.39822 407
4617 876.90458 196
4618 877.38861 146
4619 932.46898 169
4620 934.50675 148
4621 960.95152 257
4622 961.45200 184
4623 961.94188 160
4624 962.44639 177
4625 965.45475 196
4626 966.45568 135
4627 979.53772 108 1+
4628 1021.55412 145
4629 1024.96935 209
4630 1025.47693 304
4631 1026.45177 184
4632 1030.43046 2679
4633 1031.43171 1647
4634 1032.43314 5174 1+
4635 1074.51564 327
4636 1074.99635 239
4637 1075.51259 204
4638 1078.55376 189
4639 1079.55259 124
4640 1087.44873 205
4641 1089.44985 549 1+
4642 1123.98786 164
4643 1124.55951 135
4644 1125.02722 192
4645 1226.60588 216
4646 1227.59915 156
4647 END IONS
4648
4649 BEGIN IONS
4650 TITLE= Cmpd 81, +MSn(610.3171), 27.0 min
4651 PEPMASS=610.31708 553347
4652 CHARGE=3+
4653 175.10584 482
4654 187.12923 441
4655 211.10648 418
4656 212.12820 471
4657 215.13654 855
4658 217.08534 709
4659 228.13042 1103
4660 243.13148 570
4661 244.14520 1355 2+
4662 261.14815 680
4663 294.16676 598
4664 295.17886 3183 1+
4665 301.66317 307 2+
4666 303.18173 742
4667 306.66014 182 2+
4668 311.14394 505
4669 313.18669 2393 2+
4670 324.15516 409
4671 325.69719 679
4672 329.68232 1036 2+
4673 344.17827 450
4674 353.22048 465
4675 357.18890 481
4676 363.71192 538
4677 366.20817 814 2+
4678 367.70168 1058
4679 368.20878 538
4680 371.20512 994
4681 371.69103 527
4682 372.19364 475
4683 376.22410 823
4684 376.73282 524
4685 380.20798 2490 2+
4686 397.19752 513
4687 399.19587 1351
4688 416.25643 752
4689 418.22427 1032
4690 418.72920 501
4691 422.20080 410
4692 422.74818 4730 2+
4693 427.17772 140 10+
4694 428.72291 606
4695 429.20972 562
4696 429.71963 1637 2+
4697 432.77024 915
4698 433.26416 756
4699 436.75022 654
4700 437.23443 553
4701 438.72547 3275 2+
4702 441.20382 425
4703 447.18245 1090
4704 447.75056 5884 2+
4705 454.23892 456
4706 457.22530 529
4707 458.75857 1115
4708 459.26052 894
4709 463.23691 620
4710 463.72566 568
4711 468.74958 678
4712 469.25225 792
4713 470.24570 454
4714 470.76266 525
4715 471.26774 944
4716 472.25425 610
4717 473.24402 416
4718 475.24442 450
4719 478.26448 603
4720 478.76484 830
4721 479.24701 698
4722 480.23090 1071
4723 480.73216 619
4724 481.20940 477
4725 483.28011 806
4726 486.26272 531
4727 487.28312 3241 1+
4728 487.78016 1471
4729 489.23798 5268 2+
4730 493.23689 1350
4731 493.74266 651
4732 494.25587 488
4733 497.75997 652
4734 498.26516 959
4735 498.77377 431
4736 505.24625 620
4737 506.75588 504
4738 507.26111 648
4739 509.25635 429
4740 517.28246 681
4741 518.25525 525
4742 519.25913 748
4743 521.27024 1234
4744 522.26747 448
4745 522.77608 530
4746 523.27163 561
4747 525.23348 446
4748 528.25193 708
4749 530.28422 519
4750 532.27267 609
4751 535.65698 548
4752 535.97982 866
4753 536.29646 1400
4754 536.64611 455
4755 537.27788 498
4756 539.25136 1227
4757 540.26985 544
4758 541.65708 514
4759 541.98444 574
4760 542.29849 440
4761 544.31660 1233
4762 545.29334 475
4763 546.25613 1794 3+
4764 547.25622 480
4765 548.26510 629
4766 549.27486 457
4767 549.78528 716
4768 550.27686 691
4769 551.26301 468
4770 551.78075 462
4771 552.30899 515
4772 553.29753 471
4773 554.75981 541
4774 555.28200 425
4775 556.28057 836
4776 556.60510 739
4777 556.78983 480
4778 557.28918 959
4779 558.28835 877
4780 559.28749 619
4781 560.28156 651
4782 560.79567 8020 2+
4783 562.27036 1376
4784 562.63293 443
4785 562.76947 514
4786 563.27039 792
4787 564.95071 1408
4788 565.28155 1361
4789 565.61710 744
4790 566.25734 514
4791 567.27298 597
4792 569.29386 855
4793 570.95240 17218 3+
4794 573.29223 679
4795 574.28215 523
4796 575.26532 780
4797 575.57400 573
4798 576.27310 1407
4799 576.62291 1324
4800 576.95707 90559 3+
4801 578.92695 678
4802 579.28186 752
4803 580.26075 1060
4804 580.57657 744
4805 581.28000 454
4806 584.29287 436
4807 585.30222 624
4808 587.30423 5245 1+
4809 588.76991 425
4810 592.29659 428
4811 593.30745 525
4812 594.74920 423
4813 595.32166 869
4814 596.30509 677
4815 597.28800 647
4816 598.26266 414
4817 598.65602 586
4818 598.80218 441
4819 598.97438 497
4820 599.29657 1023
4821 600.30818 414
4822 600.81917 1030
4823 601.31111 2469 3+
4824 601.80789 1068
4825 602.31906 6395 1+
4826 602.82223 4570 2+
4827 604.64762 10805 3+
4828 605.78949 820
4829 606.29674 938
4830 606.82285 750
4831 607.00287 492
4832 607.31580 6069
4833 607.64455 560
4834 607.81577 11234 2+
4835 608.31813 17521 1+
4836 608.60711 452
4837 609.31945 16298 3+
4838 609.67886 12134 7+
4839 610.32528 208376 3+
4840 611.81556 16211 2+
4841 612.31301 8015 1+
4842 613.82331 28989 2+
4843 618.32279 460
4844 625.36611 3715 1+
4845 629.31446 470
4846 630.31715 684
4847 632.31915 529
4848 637.84994 966
4849 638.33318 1093
4850 646.84836 1456
4851 647.34791 1416
4852 648.34941 424
4853 649.33744 3274 1+
4854 656.37513 463
4855 658.35737 3729 1+
4856 666.36181 522
4857 668.33826 411
4858 690.34767 664
4859 691.34155 428
4860 692.32948 716
4861 714.37462 506
4862 724.84984 423
4863 726.40182 565
4864 731.40907 2711 1+
4865 734.39965 1546
4866 735.39302 929
4867 736.89377 544
4868 737.40776 458
4869 742.38390 599
4870 747.37696 840
4871 748.36219 465
4872 751.44820 615
4873 752.42373 422
4874 759.40869 3555 1+
4875 792.40972 423
4876 793.37882 731
4877 794.36579 426
4878 801.41469 4801 2+
4879 812.40809 1512
4880 813.40028 502
4881 818.88056 379 2+
4882 835.44558 504
4883 842.43408 431
4884 844.48908 407 1+
4885 848.42217 907
4886 849.43048 602
4887 849.93438 473
4888 850.42982 528
4889 856.42782 470
4890 858.43198 3764 1+
4891 858.44366 5856 2+
4892 864.48116 493
4893 872.49204 467
4894 876.44367 775 1+
4895 894.49384 1663 1+
4896 985.47932 748
4897 END IONS
4898
4899 BEGIN IONS
4900 TITLE= Cmpd 588, +MSn(764.3961), 63.5 min
4901 PEPMASS=764.39611 329352
4902 CHARGE=2+
4903 171.06574 223
4904 173.11746 1147 1+
4905 175.10731 996
4906 183.10201 748
4907 186.06517 385
4908 189.08190 293
4909 193.08463 212
4910 201.11832 3443 1+
4911 204.08594 415
4912 218.13993 157
4913 221.08846 384
4914 228.09996 514
4915 231.09473 135
4916 238.15571 180
4917 239.13604 245
4918 240.12993 182
4919 242.14430 166
4920 245.12748 273
4921 246.10861 761 1+
4922 249.15113 389
4923 250.15919 221
4924 256.15173 165
4925 263.14240 163
4926 266.15423 305
4927 272.15288 214
4928 273.12204 321
4929 276.13262 238
4930 277.14570 631 1+
4931 284.16292 5932 1+
4932 291.17628 125
4933 294.14706 393
4934 295.16645 245
4935 296.17678 180
4936 301.14856 201
4937 302.17125 941 1+
4938 304.14024 1188 1+
4939 313.18503 165
4940 314.18057 170
4941 315.17338 870 1+
4942 319.16561 806 1+
4943 322.15291 5250 1+
4944 325.66247 156
4945 326.17054 155
4946 328.18859 137
4947 329.15014 130
4948 331.19452 256
4949 332.19417 160
4950 334.17943 1597 1+
4951 341.18549 2752 1+
4952 344.19966 256
4953 345.15895 321
4954 346.16010 377
4955 349.19227 125
4956 359.19973 3261 1+
4957 363.18336 152
4958 364.16531 336
4959 365.15714 150
4960 373.17698 406
4961 374.16712 648 1+
4962 379.21447 3371 1+
4963 381.18207 2496 1+
4964 389.22506 128
4965 390.20234 303
4966 391.16823 1958 1+
4967 402.19709 232
4968 403.20331 283
4969 405.17401 236
4970 407.22941 979 1+
4971 409.18001 5822 1+
4972 415.18503 152
4973 417.21800 380
4974 418.20861 199
4975 419.18510 249
4976 420.21790 391
4977 421.21469 227
4978 427.24556 173
4979 435.22936 1779
4980 436.23331 15196 1+
4981 440.20730 131
4982 442.21260 125
4983 445.21952 158
4984 446.21829 179
4985 447.23663 1241 1+
4986 447.74264 124
4987 454.27653 135
4988 458.23003 2552 1+
4989 469.24176 129
4990 470.25225 134
4991 472.27526 365
4992 473.26321 166
4993 474.24647 152
4994 476.25247 993
4995 477.23711 2373 1+
4996 478.75195 1557 2+
4997 485.24956 135
4998 486.23252 3691 1+
4999 492.23116 225
5000 494.26385 10765 1+
5001 495.76385 191
5002 500.28300 356
5003 501.26397 195
5004 502.26644 156
5005 503.24590 375
5006 503.77148 1112 1+
5007 504.24928 8580 1+
5008 512.25505 165
5009 515.24273 129
5010 517.24011 144
5011 518.26117 1247 2+
5012 521.24381 177
5013 522.25851 19014 1+
5014 527.30621 165
5015 530.28498 248
5016 531.26924 162
5017 532.25083 264
5018 533.27274 168
5019 534.27242 181
5020 535.30234 134
5021 536.27522 1323 1+
5022 540.26787 301
5023 540.59800 216
5024 541.27462 186
5025 545.29365 129
5026 548.29939 266
5027 549.31485 4751 1+
5028 555.30607 210
5029 560.30061 179
5030 561.24618 156
5031 562.30555 226
5032 568.28909 132
5033 569.27772 227
5034 570.28427 340
5035 570.72350 201
5036 571.29296 360
5037 571.73103 233
5038 572.29604 323
5039 573.29400 188
5040 576.30531 353
5041 577.29883 147
5042 578.30703 181
5043 581.29616 160
5044 582.31358 220
5045 585.30753 2414 2+
5046 587.28850 876 1+
5047 589.32944 372
5048 590.31527 1360 1+
5049 596.78749 176
5050 597.32088 144
5051 599.31694 2239 1+
5052 602.83273 145
5053 603.30302 159
5054 604.81393 277
5055 605.29951 1578 1+
5056 605.79127 137
5057 607.34330 4358 1+
5058 610.86416 204
5059 611.32113 296
5060 613.81940 1858 2+
5061 617.32545 3855 1+
5062 623.30322 1104 1+
5063 629.30942 266
5064 630.28001 147
5065 631.30616 197
5066 632.34508 138
5067 635.34355 8168 1+
5068 638.82592 136
5069 642.33678 169
5070 643.35531 128
5071 646.34098 368
5072 646.82420 569
5073 647.32174 1098 2+
5074 650.33534 188
5075 655.33746 12039 2+
5076 659.33047 128
5077 660.35771 204
5078 662.28833 130
5079 663.36460 6478
5080 663.92017 136
5081 664.34316 20390 2+
5082 669.82812 142
5083 674.31112 124
5084 676.34560 125
5085 679.31706 156
5086 681.31759 198
5087 684.38063 164
5088 685.35625 133
5089 686.38574 138
5090 689.85484 1775 2+
5091 690.35368 1111 1+
5092 698.85462 393
5093 699.35362 2034 1+
5094 699.85209 1211 2+
5095 706.35852 160
5096 707.85585 7542 2+
5097 710.87430 134
5098 716.33474 282
5099 717.35163 182
5100 718.37036 1870 1+
5101 724.37897 329
5102 724.86715 214
5103 729.36561 155
5104 733.37489 200
5105 734.35040 675 1+
5106 736.38905 1975 1+
5107 737.88724 258
5108 738.90018 132
5109 741.86770 167
5110 742.37477 230
5111 742.88826 124
5112 744.41495 181
5113 745.34951 164
5114 745.84731 144
5115 746.39260 9013 2+
5116 749.38342 154
5117 752.35700 373
5118 752.86187 156
5119 753.35834 245
5120 755.39214 7823 2+
5121 758.70475 138
5122 759.40955 202
5123 760.37664 172
5124 760.81023 147
5125 761.38505 760 1+
5126 761.90237 202
5127 762.88454 925 2+
5128 764.40239 49270 2+
5129 767.35517 1872 2+
5130 769.39236 1251 2+
5131 770.72144 225
5132 774.39248 306
5133 775.39296 253
5134 779.35569 198
5135 780.38604 136
5136 791.39516 153
5137 792.40314 10327 1+
5138 811.41380 145
5139 829.42543 249
5140 830.39134 155
5141 842.38206 135
5142 847.42507 409
5143 848.42652 237
5144 849.42456 182
5145 857.43414 129
5146 865.44000 1286 1+
5147 874.43412 180
5148 875.44806 511
5149 876.42620 912 1+
5150 885.99756 206
5151 886.46833 304
5152 887.47530 156
5153 891.45224 137
5154 892.45784 268
5155 893.45506 30048 1+
5156 951.49253 155
5157 956.49662 1002 1+
5158 961.46361 242
5159 979.48863 1114 1+
5160 988.46949 128
5161 989.52619 220
5162 1006.53910 13746 1+
5163 1035.51506 392 1+
5164 1074.56711 163
5165 1075.54078 151
5166 1092.56749 939 1+
5167 1149.58790 159
5168 1169.60779 2038 1+
5169 1226.63151 2480 1+
5170 1327.69052 397
5171 1328.65352 376
5172 1414.71149 159
5173 1415.72336 141
5174 END IONS
5175
5176 BEGIN IONS
5177 TITLE= Cmpd 748, +MSn(789.0604), 76.1 min
5178 PEPMASS=789.06034 660608
5179 CHARGE=3+
5180 168.05363 199
5181 175.10323 160
5182 185.15328 110
5183 186.06786 1280 1+
5184 189.07388 87
5185 199.14666 158 1+
5186 200.11747 123 2+
5187 204.08304 2684 1+
5188 213.13936 102
5189 214.11683 472 1+
5190 226.11072 152
5191 227.16909 130
5192 228.13226 100
5193 229.12375 160 1+
5194 234.14014 625 1+
5195 239.17266 76
5196 243.12711 251 1+
5197 246.13650 249 1+
5198 256.13701 85
5199 260.18572 82
5200 263.13476 174 1+
5201 265.13001 273 1+
5202 269.11522 70
5203 278.15842 175 1+
5204 281.13121 75
5205 286.13626 147 1+
5206 295.11963 80
5207 298.66821 137 2+
5208 302.15750 133 1+
5209 307.14475 73
5210 316.12780 74
5211 323.66919 80
5212 326.18136 177 1+
5213 328.13774 340 1+
5214 334.16027 83
5215 339.15671 83
5216 341.20260 164
5217 345.16330 564 1+
5218 348.16022 120
5219 355.17313 95
5220 357.21382 84
5221 360.17950 113
5222 362.19421 88
5223 363.17889 367 1+
5224 366.14545 1180
5225 367.22634 92
5226 369.21146 80
5227 375.20177 295 1+
5228 376.20271 240 2+
5229 385.23033 68
5230 386.68899 117
5231 387.20360 163 1+
5232 396.16891 104
5233 399.22766 335 1+
5234 406.13893 74
5235 412.24098 74
5236 413.22153 131
5237 413.63915 69
5238 414.21827 385 1+
5239 414.72117 200 2+
5240 421.21383 73
5241 422.72891 92
5242 425.27054 73
5243 426.22874 133
5244 427.15806 101
5245 429.18971 83
5246 431.73704 100
5247 434.21429 371 2+
5248 440.23389 120 2+
5249 441.27189 188 2+
5250 443.23281 69
5251 445.21169 239
5252 449.26849 102
5253 452.19693 105
5254 453.21568 189 1+
5255 455.23734 325 1+
5256 457.73126 255 2+
5257 459.21003 210 1+
5258 460.64549 72
5259 463.02139 73
5260 463.25821 258 1+
5261 468.16591 123 8+
5262 469.22546 71
5263 470.23769 340 1+
5264 472.23497 370 1+
5265 476.27310 352 1+
5266 479.24868 271 1+
5267 484.20746 121 3+
5268 485.25192 123
5269 485.89105 128 1+
5270 487.26210 101
5271 488.27811 442 2+
5272 489.27401 123
5273 491.27610 78
5274 492.25755 208 1+
5275 494.87828 77
5276 496.25062 207 2+
5277 497.23628 225 1+
5278 499.13547 107
5279 501.28015 341 2+
5280 504.25064 180 1+
5281 505.74613 121
5282 509.23859 571 2+
5283 511.23593 93
5284 513.22563 68
5285 514.26091 321 1+
5286 515.78829 73
5287 516.21446 321 1+
5288 517.73326 490 2+
5289 518.25000 718 1+
5290 522.19963 119
5291 522.31664 249 2+
5292 522.77712 141 1+
5293 524.27252 293 1+
5294 525.73512 110
5295 526.74106 1088 2+
5296 528.75694 249 2+
5297 530.31283 154 1+
5298 532.26870 178
5299 532.76420 76
5300 533.29611 354 1+
5301 535.27418 245
5302 537.79018 104
5303 539.34769 223 1+
5304 542.26609 234 2+
5305 543.26577 158 1+
5306 544.72249 107 6+
5307 545.29314 373
5308 545.78333 382 1+
5309 545.88256 110
5310 546.79489 450 4+
5311 547.28383 391 1+
5312 550.25972 438 1+
5313 550.62882 69
5314 551.52274 69
5315 552.75107 136 1+
5316 554.22826 114
5317 555.30544 163
5318 555.72721 227 1+
5319 557.34670 138
5320 558.24887 76
5321 559.23699 112
5322 560.25782 106
5323 561.26178 244 1+
5324 565.23394 81
5325 565.77843 81
5326 568.25055 721 2+
5327 568.94839 202 3+
5328 570.80505 89
5329 571.27391 388 1+
5330 572.26405 1035 1+
5331 573.74092 546 1+
5332 574.26275 552 2+
5333 576.25250 111
5334 576.33365 126
5335 576.93162 69
5336 577.24557 241 1+
5337 578.77901 345 2+
5338 580.81822 178 1+
5339 582.25657 3840 2+
5340 585.26275 79
5341 585.81043 161 1+
5342 586.47273 347 5+
5343 588.92302 75
5344 591.30690 1071 1+
5345 591.80844 350 2+
5346 595.29272 415 1+
5347 595.57853 73
5348 597.05781 243 4+
5349 598.80308 144 1+
5350 600.36292 156 1+
5351 601.83819 718 2+
5352 603.27057 139
5353 604.36778 83
5354 605.18113 370 1+
5355 605.80898 114
5356 607.30193 553 1+
5357 610.79936 139
5358 611.82764 151
5359 612.30503 367 2+
5360 613.26953 386 1+
5361 616.28799 567 1+
5362 616.83875 250 4+
5363 620.76209 252 1+
5364 621.33942 115
5365 621.76258 334 2+
5366 623.75086 255 4+
5367 624.80527 347
5368 625.29564 419 1+
5369 626.84239 202
5370 628.30838 160
5371 628.79145 240 1+
5372 629.10440 74
5373 630.31780 272
5374 630.79751 666 2+
5375 632.32200 429 2+
5376 633.13698 141 6+
5377 634.30746 285 1+
5378 638.80144 2744 2+
5379 641.33851 363 1+
5380 642.92737 117
5381 643.32791 295 1+
5382 643.78198 143 1+
5383 645.30539 220 1+
5384 645.99810 84
5385 649.84667 239 2+
5386 650.84420 184 6+
5387 651.31398 351 2+
5388 652.86352 250 5+
5389 653.68214 292 3+
5390 653.78269 108
5391 655.31656 389 2+
5392 657.29662 393 2+
5393 658.65757 74
5394 658.80832 394 1+
5395 659.34706 696 2+
5396 659.54472 89
5397 661.30779 147
5398 662.33394 1753 1+
5399 662.98887 76
5400 664.80175 466 2+
5401 666.84377 287 1+
5402 668.29327 459 1+
5403 669.84562 161 1+
5404 671.79374 178 1+
5405 672.33360 244 1+
5406 673.84176 488 1+
5407 675.33845 591 3+
5408 677.27444 303 5+
5409 678.30609 217
5410 678.66034 96
5411 678.85301 227
5412 679.34951 647 2+
5413 681.71678 109
5414 682.34627 702 1+
5415 682.81853 88
5416 685.87534 75
5417 686.36692 91
5418 686.82152 644 1+
5419 687.32611 1211 2+
5420 690.17499 112
5421 690.35612 120
5422 691.39132 270 1+
5423 692.21982 105
5424 693.28349 95
5425 695.33855 104
5426 695.82683 2419 2+
5427 698.24550 238 3+
5428 700.84029 118 1+
5429 701.33846 413 1+
5430 703.06151 130 1+
5431 704.87622 73
5432 705.34689 316 1+
5433 706.84227 72
5434 708.91511 370 2+
5435 709.71193 77
5436 710.84413 95
5437 710.96853 130
5438 711.31883 548 3+
5439 711.97350 407 6+
5440 713.35807 76
5441 713.72056 140
5442 714.39514 286 2+
5443 716.32381 246 2+
5444 718.42336 143 1+
5445 719.73265 101
5446 721.35176 290 2+
5447 721.86309 492 1+
5448 722.87749 534 2+
5449 724.80420 256 2+
5450 726.34471 696 1+
5451 728.72303 71
5452 728.86508 321 2+
5453 730.35980 386 2+
5454 731.11079 80
5455 732.37869 341 2+
5456 733.67320 84
5457 734.35109 151
5458 734.78467 188 1+
5459 735.05526 79
5460 735.36141 304 1+
5461 736.87077 248 1+
5462 737.37398 200
5463 737.82358 694 3+
5464 737.87009 497 4+
5465 741.42422 285 1+
5466 742.34755 268 1+
5467 743.35032 1506 2+
5468 746.22281 103
5469 746.69452 254 5+
5470 746.69551 186 1+
5471 748.46110 319 5+
5472 749.36968 4433 1+
5473 749.87433 87
5474 750.00169 118
5475 750.38016 1514 3+
5476 751.39776 977 4+
5477 752.36992 3662 2+
5478 753.87813 479 4+
5479 754.68962 267 3+
5480 756.77941 179 1+
5481 757.34111 342 2+
5482 758.09667 94
5483 759.35116 267 1+
5484 759.36226 344 5+
5485 760.39301 264 4+
5486 761.80613 81
5487 762.96146 140
5488 764.38478 731 2+
5489 766.24966 85
5490 767.48425 76
5491 767.83080 169
5492 768.03997 792 3+
5493 768.87793 780 4+
5494 770.26715 94
5495 770.52342 170 1+
5496 771.38741 337 1+
5497 771.57964 265 3+
5498 772.79407 346 2+
5499 774.38687 186
5500 775.39358 348 2+
5501 775.80937 79
5502 777.39717 384 2+
5503 777.73279 151
5504 779.02079 237 1+
5505 779.38799 1104 1+
5506 780.41024 848 5+
5507 780.88302 1054 2+
5508 782.42203 1558 3+
5509 783.71879 1607 3+
5510 785.90442 1916 4+
5511 786.90744 600
5512 787.43022 773
5513 787.87240 2556 1+
5514 788.44323 3518 3+
5515 788.69040 131
5516 789.39355 6354 1+
5517 790.07854 9112 3+
5518 791.86166 2053 2+
5519 793.36353 1075 4+
5520 793.39398 1696 1+
5521 793.90508 2109 2+
5522 795.40688 748 3+
5523 799.90639 227 1+
5524 800.38263 548 1+
5525 802.85562 68
5526 806.37758 124
5527 808.42948 365 1+
5528 808.90757 940 2+
5529 810.25436 68
5530 811.38547 71
5531 812.23514 69
5532 818.47011 138 1+
5533 820.39240 186 4+
5534 822.37621 220 1+
5535 823.91467 70
5536 824.53510 190 1+
5537 828.35696 142
5538 830.44926 258 2+
5539 831.38259 240 2+
5540 833.73296 172 2+
5541 835.47722 341 1+
5542 838.39954 381 1+
5543 843.69739 348 4+
5544 849.37478 157
5545 850.46373 130 1+
5546 852.41727 483 2+
5547 853.58068 85
5548 854.41003 243 1+
5549 854.95366 75
5550 859.89074 73
5551 860.41684 126
5552 861.68267 72
5553 862.45799 2398 1+
5554 867.42131 295 1+
5555 868.02636 84
5556 872.44863 70
5557 876.46623 153
5558 879.46753 133
5559 883.46008 89
5560 885.57961 69
5561 886.91520 447 2+
5562 889.45587 95
5563 893.26286 71
5564 894.47023 74
5565 895.44332 255 1+
5566 898.11120 70
5567 906.48905 68
5568 915.95314 86
5569 916.45598 138 1+
5570 919.44999 117
5571 920.35712 126 1+
5572 922.47057 304 1+
5573 928.14763 69
5574 930.09622 255 3+
5575 931.63497 144 1+
5576 938.49247 76
5577 939.39210 81
5578 942.96554 107
5579 946.43107 72
5580 949.96936 76
5581 951.61894 68
5582 952.41378 70
5583 953.51113 146 1+
5584 964.47090 100
5585 975.54894 689 1+
5586 977.99884 69
5587 988.46161 136 1+
5588 994.47681 72
5589 1001.66182 79
5590 1005.50861 268 1+
5591 1010.52750 76
5592 1012.48182 72
5593 1030.51962 82
5594 1034.51140 144
5595 1035.42095 91
5596 1036.44483 171
5597 1042.40321 68
5598 1049.54127 75
5599 1059.53373 101
5600 1072.58198 122
5601 1084.00854 71
5602 1084.44818 74
5603 1089.61573 301
5604 1090.57148 178
5605 1092.60711 75
5606 1093.28383 83
5607 1110.53230 114
5608 1163.50587 437 1+
5609 1277.55625 82
5610 END IONS
5611
5612 BEGIN IONS
5613 TITLE= Cmpd 591, +MSn(509.9328), 63.7 min
5614 PEPMASS=509.93283 45836
5615 CHARGE=3+
5616 173.11595 2631 1+
5617 175.10557 1545
5618 183.10405 1016
5619 185.08676 437
5620 187.13044 484
5621 189.07737 835
5622 190.09059 464
5623 193.08545 712
5624 200.13298 2798
5625 201.11831 5835 1+
5626 203.10013 2607 1+
5627 213.08730 1334
5628 215.13201 1234
5629 221.08759 697
5630 226.08170 1583
5631 228.11890 2372 1+
5632 231.10045 4561 1+
5633 240.13549 456
5634 244.09556 2559 1+
5635 246.10939 842
5636 249.16104 1403
5637 258.14667 688
5638 262.12851 384
5639 270.15725 747
5640 275.16186 5169 2+
5641 277.14338 623
5642 280.15298 1130 2+
5643 284.16342 1331
5644 285.15976 501
5645 294.15087 1623
5646 295.14764 531
5647 304.16173 698
5648 305.16441 916
5649 306.17490 646
5650 311.17481 683
5651 312.16390 605
5652 315.16128 1341
5653 315.66371 442
5654 317.15971 435
5655 318.17103 707
5656 319.16883 502
5657 322.15373 4774 2+
5658 323.16232 1016
5659 323.66899 1638 2+
5660 326.16913 559
5661 327.14363 552
5662 332.18328 2829 2+
5663 334.19157 1966 2+
5664 335.18419 455
5665 339.19472 976
5666 341.18747 692
5667 341.69380 474
5668 342.19453 474
5669 344.18861 542
5670 345.14909 6841 1+
5671 345.69542 462
5672 350.69177 513
5673 351.18508 609
5674 357.20804 954
5675 358.20354 408
5676 359.19827 1114
5677 359.69467 8141 2+
5678 362.18213 490
5679 363.17826 553
5680 364.16635 568
5681 368.69976 3396 2+
5682 373.16230 829
5683 374.15031 560
5684 379.20906 9250 2+
5685 380.20940 1942
5686 381.18352 4692 1+
5687 388.19641 960 2+
5688 391.17340 2736 1+
5689 396.70520 1964 2+
5690 401.19429 414
5691 402.22981 679
5692 403.20062 465
5693 406.20710 890
5694 406.71635 439
5695 407.23140 1067
5696 407.69915 665
5697 409.17939 7221 1+
5698 413.20911 1097
5699 415.21177 690
5700 415.70747 450
5701 416.21544 401
5702 417.21388 991
5703 418.21058 590
5704 419.20920 2725 2+
5705 420.21346 791
5706 424.21505 6638 2+
5707 429.71412 1051
5708 430.22533 1295
5709 431.23508 468
5710 432.23691 471
5711 433.22108 598
5712 435.22372 2413 2+
5713 436.23419 114800 1+
5714 438.72215 8297 2+
5715 441.19784 518
5716 442.22508 672
5717 446.21982 1162
5718 447.23193 6324 2+
5719 453.23169 428
5720 458.23306 3732 2+
5721 459.23135 1552
5722 460.24217 555
5723 463.21732 447
5724 467.73368 500
5725 468.23824 525
5726 472.24587 669
5727 472.73946 394
5728 473.24644 481
5729 476.25340 1259
5730 477.24763 1567
5731 478.23810 724
5732 480.22319 384
5733 481.23881 685
5734 481.75682 524
5735 486.24100 3334 2+
5736 487.22784 1267
5737 488.23985 475
5738 490.24462 2755 2+
5739 492.23120 863
5740 493.22964 428
5741 494.26272 10740 1+
5742 494.76998 458
5743 495.76229 577
5744 498.25771 716
5745 499.24315 459
5746 500.25909 613
5747 501.25752 467
5748 502.23978 456
5749 503.29494 515
5750 503.77672 1087
5751 504.25193 8834 1+
5752 504.60034 619
5753 506.56664 378
5754 507.22128 7278 1+
5755 507.71103 1758
5756 508.21426 6527 2+
5757 511.89830 1253
5758 512.23878 1310
5759 512.55518 1611
5760 512.88851 1152
5761 513.24575 1092
5762 513.59244 394
5763 514.25578 455
5764 515.25871 458
5765 518.26644 986
5766 519.27136 493
5767 520.27205 467
5768 521.77949 438
5769 522.26035 19306 1+
5770 524.78844 418
5771 526.28298 500
5772 532.28902 705
5773 533.29224 523
5774 534.23823 421
5775 536.27289 975
5776 539.29216 637
5777 543.30211 403
5778 546.26374 526
5779 548.29037 587
5780 549.31645 21010 1+
5781 553.27118 425
5782 559.29869 4373 1+
5783 564.27648 380
5784 568.30517 5770 1+
5785 576.29187 457
5786 576.78817 677
5787 577.29892 658
5788 578.29939 407
5789 585.29566 515
5790 587.29093 905
5791 588.28656 787
5792 590.31943 1002
5793 591.32019 481
5794 599.31662 1648
5795 600.31627 911
5796 604.80197 495
5797 605.29785 4744 1+
5798 605.80385 540
5799 607.33196 4170 1+
5800 617.32307 3801 1+
5801 621.30488 642
5802 623.30417 1314
5803 624.30186 459
5804 629.30371 591
5805 630.30133 394
5806 633.29994 396
5807 635.34153 8145 1+
5808 643.30018 730 1+
5809 646.33070 7284 1+
5810 646.82369 668
5811 655.32372 583
5812 655.83479 1012
5813 656.34217 719
5814 656.85228 405
5815 663.35929 28903 1+
5816 664.85206 473
5817 667.37586 1581 1+
5818 672.33723 381
5819 674.33663 1308
5820 675.34251 571
5821 681.32897 457
5822 681.84372 405
5823 682.35367 697
5824 690.34628 1008
5825 690.84840 536
5826 691.35686 574
5827 698.84832 506
5828 699.34271 1200
5829 699.84382 788
5830 700.36933 1328
5831 701.37759 500
5832 708.37701 564
5833 710.79707 419
5834 711.79199 426
5835 716.33050 691
5836 717.34037 442
5837 718.38207 5509 1+
5838 734.34804 1145
5839 735.34752 834
5840 736.39224 2117 1+
5841 752.34853 853
5842 753.36007 412
5843 757.41084 901 1+
5844 761.35559 446
5845 762.34727 412
5846 766.48607 588
5847 774.39155 959
5848 775.38554 6730 1+
5849 779.37133 414
5850 792.40313 10054 1+
5851 803.38441 992
5852 829.40715 545
5853 830.39938 587
5854 831.38906 464
5855 837.41113 942 1+
5856 847.42282 2950 1+
5857 858.41857 399
5858 865.44249 1698
5859 866.41430 1495
5860 867.52772 588
5861 869.44017 230 1+
5862 875.43106 546
5863 876.43702 5104 1+
5864 893.45658 8739 1+
5865 915.45885 333 1+
5866 943.45179 791
5867 944.46504 665
5868 961.47030 830
5869 962.46146 928
5870 971.47473 200 1+
5871 979.48197 4959 1+
5872 989.53004 584
5873 1006.54607 892
5874 1007.53391 495
5875 END IONS
5876
5877 BEGIN IONS
5878 TITLE= Cmpd 204, +MSn(524.2825), 35.5 min
5879 PEPMASS=524.28252 121118
5880 CHARGE=3+
5881 155.10117 348
5882 175.11028 361
5883 183.10336 5108 1+
5884 187.13047 225
5885 199.17421 2625
5886 200.13196 33224 1+
5887 211.10594 1225 1+
5888 215.12409 361
5889 226.13432 500
5890 227.17006 1847
5891 228.13144 18133 1+
5892 232.13692 1304 1+
5893 235.10842 221
5894 237.15965 256
5895 242.18076 795
5896 243.14286 407
5897 246.11492 364
5898 249.16132 282
5899 253.00067 249
5900 254.15788 833
5901 255.00060 369
5902 255.16767 782
5903 260.19709 4827 1+
5904 265.15351 223
5905 270.15767 4430 2+
5906 277.14641 230
5907 279.17162 1374 1+
5908 282.16704 1911 1+
5909 296.20389 694
5910 300.15278 383
5911 301.12576 370
5912 307.16584 651
5913 308.17510 252
5914 309.18899 245
5915 313.21852 850
5916 314.19522 321
5917 323.20753 452
5918 324.19096 1657 1+
5919 330.16744 240
5920 331.19963 1920 1+
5921 338.16763 376
5922 341.21918 7076 4+
5923 342.19219 2562 2+
5924 343.22059 451
5925 350.24866 1120 1+
5926 355.20585 407
5927 359.19970 689
5928 360.18583 344
5929 361.68768 266 2+
5930 367.19099 244
5931 368.24304 252
5932 378.20951 295
5933 379.04198 240
5934 380.15312 263
5935 386.22588 261
5936 394.20036 279
5937 397.18930 219
5938 401.14990 1748 2+
5939 402.24387 4608 1+
5940 402.65659 605
5941 403.70861 233
5942 409.22811 1394 2+
5943 410.15152 1752 2+
5944 410.88985 505
5945 411.17602 3045 2+
5946 413.24164 444
5947 414.22362 486
5948 416.22110 413
5949 416.70940 292
5950 417.22857 251
5951 418.23474 381
5952 421.25238 294
5953 421.73966 244
5954 426.21675 248
5955 428.22972 239
5956 429.17325 315
5957 430.17075 270
5958 434.25838 238
5959 438.24279 321
5960 440.24187 308
5961 442.56097 225
5962 443.23417 364
5963 445.20653 278
5964 446.25552 1309 1+
5965 448.58149 2092 3+
5966 448.71546 222
5967 450.15162 299
5968 450.65043 351
5969 451.15276 567
5970 451.67050 255
5971 452.22354 223
5972 454.30122 754
5973 457.73387 510
5974 458.21297 530
5975 458.66576 597
5976 459.17771 3056 2+
5977 463.22023 246
5978 464.24895 327
5979 466.19192 10003 1+
5980 466.69777 7075 2+
5981 468.17898 6393 2+
5982 471.22935 282
5983 471.72203 287
5984 472.23038 358
5985 472.65587 1706 2+
5986 473.66287 1513 2+
5987 475.26616 350
5988 475.74949 7282 2+
5989 479.25400 287
5990 480.24997 378
5991 481.24971 260
5992 482.22266 234
5993 483.24891 550
5994 483.75051 637
5995 484.25605 674
5996 484.76780 348
5997 485.25215 304
5998 486.27652 3378 3+
5999 488.25512 315
6000 488.74086 623
6001 489.24804 505
6002 489.60421 5115 3+
6003 490.11852 315
6004 491.10403 234
6005 491.25857 304
6006 491.76888 299
6007 492.23741 293
6008 492.77542 301
6009 492.94213 253
6010 493.25294 3243 2+
6011 493.61104 285
6012 493.92789 283
6013 495.26160 350
6014 496.27081 342
6015 497.21431 248
6016 497.73865 1675 2+
6017 498.93795 3860 3+
6018 500.26886 363
6019 501.23989 781
6020 501.76795 13523 2+
6021 503.76949 3133 2+
6022 506.25384 2984 1+
6023 506.72395 542
6024 506.92214 2573 3+
6025 508.13403 378
6026 510.24437 2756 2+
6027 512.25955 500
6028 512.62404 457
6029 512.94077 21422 3+
6030 514.71510 1155
6031 515.21383 2199
6032 515.72374 10778 2+
6033 517.93443 646
6034 518.28260 13998 3+
6035 521.28683 452
6036 521.56374 372
6037 521.76339 284
6038 521.91923 326
6039 522.24967 3064 1+
6040 522.78132 1390
6041 523.72516 64261 1+
6042 524.23217 11234
6043 524.94550 1582
6044 525.26711 48416 2+
6045 526.53100 255
6046 527.21581 7168
6047 527.71377 20425 2+
6048 530.26002 455
6049 534.25025 312
6050 535.26329 384
6051 536.28811 274
6052 537.28924 392
6053 538.26822 297
6054 539.30807 7017 1+
6055 541.76035 328
6056 542.28618 574
6057 542.76378 381
6058 543.27684 602
6059 549.28903 361
6060 550.28398 766
6061 550.77316 2320 2+
6062 555.30352 459
6063 557.30677 379
6064 558.26941 517
6065 559.28509 33371 2+
6066 562.29648 266
6067 564.25243 463
6068 564.78649 228
6069 565.29024 326
6070 569.30831 259
6071 576.27394 235
6072 582.26157 398
6073 585.28501 257
6074 590.30827 376
6075 594.28295 1596 1+
6076 599.30416 261
6077 602.34436 249
6078 603.35006 234
6079 604.33465 386
6080 605.32957 236
6081 606.31089 307
6082 606.81906 1107
6083 607.31452 4285 2+
6084 614.82734 236
6085 615.30599 247
6086 615.82587 63376 2+
6087 619.18336 285
6088 620.82708 287
6089 621.31931 585
6090 622.31862 362
6091 638.31668 275
6092 639.31129 326
6093 640.34296 266
6094 645.18213 232
6095 647.19066 256
6096 648.32360 252
6097 650.33238 225
6098 654.28084 231
6099 654.87083 245
6100 655.35521 382
6101 656.36221 326
6102 662.34087 247
6103 663.36119 731
6104 663.85229 2941 2+
6105 669.36335 246
6106 671.33727 773
6107 671.87836 477
6108 672.36859 92472 2+
6109 676.30154 383
6110 677.34589 715
6111 677.87484 242
6112 681.43108 239 2+
6113 682.33415 228
6114 683.37711 1275 1+
6115 689.34719 4920 1+
6116 704.36673 294
6117 711.28085 605
6118 720.38724 318
6119 722.36809 2276 1+
6120 725.38632 335
6121 725.88345 243
6122 728.91114 5096 2+
6123 733.37743 663
6124 733.90267 9462 2+
6125 743.32913 238
6126 775.43439 834
6127 776.41090 351
6128 777.40820 278
6129 784.37111 2315 1+
6130 790.35711 724
6131 791.35297 405
6132 801.29252 478 1+
6133 803.29086 477
6134 804.32001 303
6135 817.44894 1604 1+
6136 819.29576 1483 1+
6137 821.34477 2052 1+
6138 858.38227 360
6139 903.45006 245
6140 931.49625 610
6141 932.38827 895 1+
6142 935.35068 813 1+
6143 944.30447 498 1+
6144 946.31847 531 1+
6145 971.46111 499
6146 1002.52863 762 1+
6147 1084.53371 468
6148 1099.54819 244
6149 1100.53904 486 1+
6150 1117.55479 637
6151 1118.57910 362
6152 END IONS
6153