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Targeted MS Runs
2_Plasma_Lipid_Library_Negative.sky.zip
NCSU Baker Lab - Lipid Libraries
Document Summary
2_Plasma_Lipid_Library_Negative.sky.zip
364 KB
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1 version
14 molecule lists
,
306 small molecules
,
368 precursors
,
3,058 transitions
-
0 replicates
- Skyline-daily (64-bit) 20.2.1.404 (32d27b598)
Small Molecule Precursor List
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Molecule List
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Description
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Molecule List Note/Annotations
Cer (Ceramide)
Molecule
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Precursor
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Q1 Z
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Q1 m/z
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Transition Count
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Cer(d18:1/18:0)
C36H71NO3
565.9592
565.5434
Cer(d18:1/18:0)
1-
624.5572
565.9592
565.5434
9
Cer(d18:1/18:0)
C36H71NO3
565.9592
565.5434
Cer(d18:1/18:0)
1-
610.5416
565.9592
565.5434
9
Cer(d18:1/18:0)
C36H71NO3
565.9592
565.5434
Cer(d18:1/18:0)
1-
564.5361
565.9592
565.5434
9
Cer(d18:2/20:0)
C38H73NO3
591.9968
591.5590
Cer(d18:2/20:0)
1-
650.5729
591.9968
591.5590
9
Cer(d18:2/20:0)
C38H73NO3
591.9968
591.5590
Cer(d18:2/20:0)
1-
636.5572
591.9968
591.5590
9
Cer(d18:2/20:0)
C38H73NO3
591.9968
591.5590
Cer(d18:2/20:0)
1-
590.5518
591.9968
591.5590
9
Cer(d18:1/20:0)
C38H75NO3
594.0127
593.5747
Cer(d18:1/20:0)
1-
652.5885
594.0127
593.5747
9
Cer(d18:1/20:0)
C38H75NO3
594.0127
593.5747
Cer(d18:1/20:0)
1-
638.5729
594.0127
593.5747
9
Cer(d18:1/20:0)
C38H75NO3
594.0127
593.5747
Cer(d18:1/20:0)
1-
592.5674
594.0127
593.5747
9
Cer(d16:1/23:0)
C39H77NO3
608.0394
607.5903
Cer(d16:1/23:0)
1-
666.6042
608.0394
607.5903
9
Cer(d16:1/23:0)
C39H77NO3
608.0394
607.5903
Cer(d16:1/23:0)
1-
606.5831
608.0394
607.5903
9
Cer(d16:1/24:1)
C40H77NO3
620.0503
619.5903
Cer(d16:1/24:1)
1-
678.6042
620.0503
619.5903
9
Cer(d16:1/24:1)
C40H77NO3
620.0503
619.5903
Cer(d16:1/24:1)
1-
664.5885
620.0503
619.5903
9
Cer(d16:1/24:1)
C40H77NO3
620.0503
619.5903
Cer(d16:1/24:1)
1-
618.5831
620.0503
619.5903
9
Cer(d18:2/22:0)
C40H77NO3
620.0503
619.5903
Cer(d18:2/22:0)
1-
678.6042
620.0503
619.5903
9
Cer(d18:2/22:0)
C40H77NO3
620.0503
619.5903
Cer(d18:2/22:0)
1-
664.5885
620.0503
619.5903
9
Cer(d18:2/22:0)
C40H77NO3
620.0503
619.5903
Cer(d18:2/22:0)
1-
618.5831
620.0503
619.5903
9
Cer(d16:1/24:0);Cer(d18:1/22:0)
C40H79NO3
622.0662
621.6060
Cer(d16:1/24:0);Cer(d18:1/22:0)
1-
680.6198
622.0662
621.6060
15
Cer(d16:1/24:0);Cer(d18:1/22:0)
C40H79NO3
622.0662
621.6060
Cer(d16:1/24:0);Cer(d18:1/22:0)
1-
666.6042
622.0662
621.6060
15
Cer(d16:1/24:0);Cer(d18:1/22:0)
C40H79NO3
622.0662
621.6060
Cer(d16:1/24:0);Cer(d18:1/22:0)
1-
620.5987
622.0662
621.6060
15
Cer(d18:0/22:0)
C40H81NO3
624.0820
623.6216
Cer(d18:0/22:0)
1-
682.6355
624.0820
623.6216
9
Cer(d18:0/22:0)
C40H81NO3
624.0820
623.6216
Cer(d18:0/22:0)
1-
668.6198
624.0820
623.6216
9
Cer(d18:0/22:0)
C40H81NO3
624.0820
623.6216
Cer(d18:0/22:0)
1-
622.6144
624.0820
623.6216
9
Cer(d18:2/23:0)
C41H79NO3
634.0770
633.6060
Cer(d18:2/23:0)
1-
692.6198
634.0770
633.6060
9
Cer(d18:2/23:0)
C41H79NO3
634.0770
633.6060
Cer(d18:2/23:0)
1-
678.6042
634.0770
633.6060
9
Cer(d18:2/23:0)
C41H79NO3
634.0770
633.6060
Cer(d18:2/23:0)
1-
632.5987
634.0770
633.6060
9
Cer(d18:1/23:0)
C41H81NO3
636.0929
635.6216
Cer(d18:1/23:0)
1-
694.6355
636.0929
635.6216
9
Cer(d18:1/23:0)
C41H81NO3
636.0929
635.6216
Cer(d18:1/23:0)
1-
680.6198
636.0929
635.6216
9
Cer(d18:1/23:0)
C41H81NO3
636.0929
635.6216
Cer(d18:1/23:0)
1-
634.6144
636.0929
635.6216
9
Cer(d18:2/24:1)
C42H79NO3
646.0879
645.6060
Cer(d18:2/24:1)
1-
704.6198
646.0879
645.6060
8
Cer(d18:2/24:1)
C42H79NO3
646.0879
645.6060
Cer(d18:2/24:1)
1-
690.6042
646.0879
645.6060
9
Cer(d18:2/24:1)
C42H79NO3
646.0879
645.6060
Cer(d18:2/24:1)
1-
644.5987
646.0879
645.6060
9
Cer(d18:1/24:1)
C42H81NO3
648.1037
647.6216
Cer(d18:1/24:1)
1-
706.6355
648.1037
647.6216
9
Cer(d18:1/24:1)
C42H81NO3
648.1037
647.6216
Cer(d18:1/24:1)
1-
692.6198
648.1037
647.6216
9
Cer(d18:1/24:1)
C42H81NO3
648.1037
647.6216
Cer(d18:1/24:1)
1-
646.6144
648.1037
647.6216
9
Cer(d18:2/24:0)
C42H81NO3
648.1037
647.6216
Cer(d18:2/24:0)
1-
706.6355
648.1037
647.6216
9
Cer(d18:2/24:0)
C42H81NO3
648.1037
647.6216
Cer(d18:2/24:0)
1-
692.6198
648.1037
647.6216
9
Cer(d18:2/24:0)
C42H81NO3
648.1037
647.6216
Cer(d18:2/24:0)
1-
646.6144
648.1037
647.6216
9
Cer(d18:1/24:0)
C42H83NO3
650.1196
649.6373
Cer(d18:1/24:0)
1-
708.6511
650.1196
649.6373
9
Cer(d18:1/24:0)
C42H83NO3
650.1196
649.6373
Cer(d18:1/24:0)
1-
694.6355
650.1196
649.6373
9
Cer(d18:1/24:0)
C42H83NO3
650.1196
649.6373
Cer(d18:1/24:0)
1-
648.6300
650.1196
649.6373
9
Cer(d18:1/25:0)
C43H85NO3
664.1463
663.6529
Cer(d18:1/25:0)
1-
722.6668
664.1463
663.6529
9
Cer(d18:1/25:0)
C43H85NO3
664.1463
663.6529
Cer(d18:1/25:0)
1-
708.6511
664.1463
663.6529
9
Cer(d18:1/25:0)
C43H85NO3
664.1463
663.6529
Cer(d18:1/25:0)
1-
662.6457
664.1463
663.6529
9
Cer(d19:1/24:0)
C43H85NO3
664.1463
663.6529
Cer(d19:1/24:0)
1-
722.6668
664.1463
663.6529
9
Cer(d19:1/24:0)
C43H85NO3
664.1463
663.6529
Cer(d19:1/24:0)
1-
708.6511
664.1463
663.6529
9
Cer(d19:1/24:0)
C43H85NO3
664.1463
663.6529
Cer(d19:1/24:0)
1-
662.6457
664.1463
663.6529
9
FA (Fatty acyl)
Molecule
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Q1 Z
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FA 12:0
C12H24O2
200.3196
200.1776
FA 12:0
1-
199.1704
200.3196
200.1776
3
FA 13:0
C13H26O2
214.3463
214.1933
FA 13:0
1-
213.1860
214.3463
214.1933
3
FA 14:2
C14H24O2
224.3413
224.1776
FA 14:2
1-
223.1704
224.3413
224.1776
3
FA 14:1
C14H26O2
226.3571
226.1933
FA 14:1
1-
225.1860
226.3571
226.1933
3
FA 14:0
C14H28O2
228.3730
228.2089
FA 14:0
1-
227.2017
228.3730
228.2089
3
FA 15:1
C15H28O2
240.3839
240.2089
FA 15:1
1-
239.2017
240.3839
240.2089
3
FA 15:0a
C15H30O2
242.3997
242.2246
FA 15:0a
1-
241.2173
242.3997
242.2246
3
FA 15:0b
C15H30O2
242.3997
242.2246
FA 15:0b
1-
241.2173
242.3997
242.2246
3
FA 16:2
C16H28O2
252.3947
252.2089
FA 16:2
1-
251.2017
252.3947
252.2089
3
FA 16:1
C16H30O2
254.4106
254.2246
FA 16:1
1-
253.2173
254.4106
254.2246
3
FA 16:0
C16H32O2
256.4265
256.2402
FA 16:0
1-
255.2330
256.4265
256.2402
3
FA 17:2
C17H30O2
266.4214
266.2246
FA 17:2
1-
265.2173
266.4214
266.2246
3
FA 17:1a
C17H32O2
268.4373
268.2402
FA 17:1a
1-
267.2330
268.4373
268.2402
3
FA 17:1b
C17H32O2
268.4373
268.2402
FA 17:1b
1-
267.2330
268.4373
268.2402
3
FA 17:0a
C17H34O2
270.4532
270.2559
FA 17:0a
1-
269.2486
270.4532
270.2559
3
FA 17:0b
C17H34O2
270.4532
270.2559
FA 17:0b
1-
269.2486
270.4532
270.2559
3
FA 18:4
C18H28O2
276.4164
276.2089
FA 18:4
1-
275.2017
276.4164
276.2089
3
FA 18:3
C18H30O2
278.4323
278.2246
FA 18:3
1-
277.2173
278.4323
278.2246
3
FA 18:2
C18H32O2
280.4482
280.2402
FA 18:2
1-
279.2330
280.4482
280.2402
3
FA 18:1
C18H34O2
282.4641
282.2559
FA 18:1
1-
281.2486
282.4641
282.2559
3
FA 18:0
C18H36O2
284.4799
284.2715
FA 18:0
1-
283.2643
284.4799
284.2715
3
FA 19:3
C19H32O2
292.4590
292.2402
FA 19:3
1-
291.2330
292.4590
292.2402
3
FA 19:1a
C19H36O2
296.4908
296.2715
FA 19:1a
1-
295.2643
296.4908
296.2715
3
FA 19:1b
C19H36O2
296.4908
296.2715
FA 19:1b
1-
295.2643
296.4908
296.2715
3
FA 19:0a
C19H38O2
298.5067
298.2872
FA 19:0a
1-
297.2799
298.5067
298.2872
3
FA 19:0b
C19H38O2
298.5067
298.2872
FA 19:0b
1-
297.2799
298.5067
298.2872
3
FA 20:5
C20H30O2
302.4540
302.2246
FA 20:5
1-
301.2173
302.4540
302.2246
3
FA 20:4
C20H32O2
304.4699
304.2402
FA 20:4
1-
303.2330
304.4699
304.2402
3
FA 20:3a
C20H34O2
306.4858
306.2559
FA 20:3a
1-
305.2486
306.4858
306.2559
3
FA 20:3b
C20H34O2
306.4858
306.2559
FA 20:3b
1-
305.2486
306.4858
306.2559
3
FA 20:2
C20H36O2
308.5016
308.2715
FA 20:2
1-
307.2643
308.5016
308.2715
3
FA 20:1
C20H38O2
310.5175
310.2872
FA 20:1
1-
309.2799
310.5175
310.2872
3
FA 20:0a
C20H40O2
312.5334
312.3028
FA 20:0a
1-
311.2956
312.5334
312.3028
3
FA 20:0b
C20H40O2
312.5334
312.3028
FA 20:0b
1-
311.2956
312.5334
312.3028
3
FA 21:0a
C21H42O2
326.5601
326.3185
FA 21:0a
1-
325.3112
326.5601
326.3185
3
FA 21:0b
C21H42O2
326.5601
326.3185
FA 21:0b
1-
325.3112
326.5601
326.3185
3
FA 22:6
C22H32O2
328.4916
328.2402
FA 22:6
1-
327.2330
328.4916
328.2402
3
FA 22:5
C22H34O2
330.5075
330.2559
FA 22:5
1-
329.2486
330.5075
330.2559
3
FA 22:4
C22H36O2
332.5233
332.2715
FA 22:4
1-
331.2643
332.5233
332.2715
3
FA 22:3a
C22H38O2
334.5392
334.2872
FA 22:3a
1-
333.2799
334.5392
334.2872
3
FA 22:3b
C22H38O2
334.5392
334.2872
FA 22:3b
1-
333.2799
334.5392
334.2872
3
FA 22:2
C22H40O2
336.5551
336.3028
FA 22:2
1-
335.2956
336.5551
336.3028
3
FA 22:1
C22H42O2
338.5710
338.3185
FA 22:1
1-
337.3112
338.5710
338.3185
3
FA 22:0
C22H44O2
340.5869
340.3341
FA 22:0
1-
339.3269
340.5869
340.3341
3
FA 23:0
C23H46O2
354.6136
354.3498
FA 23:0
1-
353.3425
354.6136
354.3498
3
FA 24:1
C24H46O2
366.6244
366.3498
FA 24:1
1-
365.3425
366.6244
366.3498
3
FA 24:0a
C24H48O2
368.6403
368.3654
FA 24:0a
1-
367.3582
368.6403
368.3654
3
FA 24:0b
C24H48O2
368.6403
368.3654
FA 24:0b
1-
367.3582
368.6403
368.3654
3
FA 25:0
C25H50O2
382.6671
382.3811
FA 25:0
1-
381.3738
382.6671
382.3811
3
FA 26:0a
C26H52O2
396.6938
396.3967
FA 26:0a
1-
395.3895
396.6938
396.3967
3
FA 26:0b
C26H52O2
396.6938
396.3967
FA 26:0b
1-
395.3895
396.6938
396.3967
3
GM3 (Ganglioside)
Molecule
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Ion Formula
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Q1 Z
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GM3(d18:1/16:0)
C57H104N2O21
1153.4450
1152.7132
GM3(d18:1/16:0)
1-
1151.7059
1153.4450
1152.7132
9
GM3(d18:1/18:0)
C59H108N2O21
1181.4985
1180.7445
GM3(d18:1/18:0)
1-
1179.7372
1181.4985
1180.7445
9
GM3(d18:1/22:0)
C63H116N2O21
1237.6054
1236.8071
GM3(d18:1/22:0)
1-
1235.7998
1237.6054
1236.8071
9
GM3(d18:1/24:0)
C65H120N2O21
1265.6589
1264.8384
GM3(d18:1/24:0)
1-
1263.8311
1265.6589
1264.8384
9
HexCer (Glc/Glu Glycosphingolipid)
Molecule
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Q1 Z
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HexCer(d18:1/20:0)
C44H85NO8
756.1542
755.6275
HexCer(d18:1/20:0)
1-
814.6414
756.1542
755.6275
11
HexCer(d18:1/20:0)
C44H85NO8
756.1542
755.6275
HexCer(d18:1/20:0)
1-
800.6257
756.1542
755.6275
11
HexCer(d18:1/20:0)
C44H85NO8
756.1542
755.6275
HexCer(d18:1/20:0)
1-
754.6202
756.1542
755.6275
9
HexCer(d18:2/22:0)
C46H87NO8
782.1918
781.6432
HexCer(d18:2/22:0)
1-
840.6570
782.1918
781.6432
11
HexCer(d18:2/22:0)
C46H87NO8
782.1918
781.6432
HexCer(d18:2/22:0)
1-
826.6414
782.1918
781.6432
11
HexCer(d18:2/22:0)
C46H87NO8
782.1918
781.6432
HexCer(d18:2/22:0)
1-
780.6359
782.1918
781.6432
11
HexCer(d18:1/22:0)
C46H89NO8
784.2077
783.6588
HexCer(d18:1/22:0)
1-
842.6727
784.2077
783.6588
11
HexCer(d18:1/22:0)
C46H89NO8
784.2077
783.6588
HexCer(d18:1/22:0)
1-
828.6570
784.2077
783.6588
11
HexCer(d18:1/22:0)
C46H89NO8
784.2077
783.6588
HexCer(d18:1/22:0)
1-
782.6515
784.2077
783.6588
11
HexCer(d18:1/23:0)
C47H91NO8
798.2344
797.6745
HexCer(d18:1/23:0)
1-
856.6883
798.2344
797.6745
11
HexCer(d18:1/23:0)
C47H91NO8
798.2344
797.6745
HexCer(d18:1/23:0)
1-
842.6727
798.2344
797.6745
11
HexCer(d18:1/23:0)
C47H91NO8
798.2344
797.6745
HexCer(d18:1/23:0)
1-
796.6672
798.2344
797.6745
11
HexCer(d18:2/24:1)
C48H89NO8
808.2294
807.6588
HexCer(d18:2/24:1)
1-
866.6727
808.2294
807.6588
11
HexCer(d18:2/24:1)
C48H89NO8
808.2294
807.6588
HexCer(d18:2/24:1)
1-
852.6570
808.2294
807.6588
11
HexCer(d18:2/24:1)
C48H89NO8
808.2294
807.6588
HexCer(d18:2/24:1)
1-
806.6515
808.2294
807.6588
11
HexCer(d18:1/24:1)
C48H91NO8
810.2452
809.6745
HexCer(d18:1/24:1)
1-
868.6883
810.2452
809.6745
11
HexCer(d18:1/24:1)
C48H91NO8
810.2452
809.6745
HexCer(d18:1/24:1)
1-
854.6727
810.2452
809.6745
11
HexCer(d18:1/24:1)
C48H91NO8
810.2452
809.6745
HexCer(d18:1/24:1)
1-
808.6672
810.2452
809.6745
11
HexCer(d18:2/24:0)
C48H91NO8
810.2452
809.6745
HexCer(d18:2/24:0)
1-
868.6883
810.2452
809.6745
11
HexCer(d18:2/24:0)
C48H91NO8
810.2452
809.6745
HexCer(d18:2/24:0)
1-
854.6727
810.2452
809.6745
11
HexCer(d18:2/24:0)
C48H91NO8
810.2452
809.6745
HexCer(d18:2/24:0)
1-
808.6672
810.2452
809.6745
11
HexCer(d18:1/24:0)
C48H93NO8
812.2611
811.6901
HexCer(d18:1/24:0)
1-
870.7040
812.2611
811.6901
11
HexCer(d18:1/24:0)
C48H93NO8
812.2611
811.6901
HexCer(d18:1/24:0)
1-
856.6883
812.2611
811.6901
11
HexCer(d18:1/24:0)
C48H93NO8
812.2611
811.6901
HexCer(d18:1/24:0)
1-
810.6828
812.2611
811.6901
11
LPC (Lyso phosphatidylcholine)
Molecule
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Precursor
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Q1 Z
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LPC(0:0/14:0)
C22H46NO7P
467.5802
467.3012
LPC(0:0/14:0)
1-
526.3150
467.5802
467.3012
6
LPC(14:0/0:0)
C22H46NO7P
467.5802
467.3012
LPC(14:0/0:0)
1-
526.3150
467.5802
467.3012
6
LPC(0:0/15:0)
C23H48NO7P
481.6069
481.3168
LPC(0:0/15:0)
1-
540.3307
481.6069
481.3168
6
LPC(15:0/0:0)
C23H48NO7P
481.6069
481.3168
LPC(15:0/0:0)
1-
540.3307
481.6069
481.3168
6
LPC(0:0/16:1)
C24H48NO7P
493.6178
493.3168
LPC(0:0/16:1)
1-
552.3307
493.6178
493.3168
6
LPC(16:1/0:0)
C24H48NO7P
493.6178
493.3168
LPC(16:1/0:0)
1-
552.3307
493.6178
493.3168
6
LPC(0:0/16:0)
C24H50NO7P
495.6337
495.3325
LPC(0:0/16:0)
1-
554.3463
495.6337
495.3325
6
LPC(16:0/0:0)
C24H50NO7P
495.6337
495.3325
LPC(16:0/0:0)
1-
554.3463
495.6337
495.3325
6
LPC(0:0/17:0)
C25H52NO7P
509.6604
509.3481
LPC(0:0/17:0)
1-
568.3620
509.6604
509.3481
6
LPC(17:0/0:0)
C25H52NO7P
509.6604
509.3481
LPC(17:0/0:0)
1-
568.3620
509.6604
509.3481
6
LPC(0:0/18:3)
C26H48NO7P
517.6395
517.3168
LPC(0:0/18:3)
1-
576.3307
517.6395
517.3168
6
LPC(18:3/0:0)
C26H48NO7P
517.6395
517.3168
LPC(18:3/0:0)
1-
576.3307
517.6395
517.3168
6
LPC(0:0/18:2)
C26H50NO7P
519.6554
519.3325
LPC(0:0/18:2)
1-
578.3463
519.6554
519.3325
6
LPC(18:2/0:0)
C26H50NO7P
519.6554
519.3325
LPC(18:2/0:0)
1-
578.3463
519.6554
519.3325
6
LPC(0:0/18:1)
C26H52NO7P
521.6712
521.3481
LPC(0:0/18:1)
1-
580.3620
521.6712
521.3481
6
LPC(18:1/0:0)
C26H52NO7P
521.6712
521.3481
LPC(18:1/0:0)
1-
580.3620
521.6712
521.3481
6
LPC(0:0/18:0)
C26H54NO7P
523.6871
523.3638
LPC(0:0/18:0)
1-
582.3776
523.6871
523.3638
6
LPC(18:0/0:0)
C26H54NO7P
523.6871
523.3638
LPC(18:0/0:0)
1-
582.3776
523.6871
523.3638
6
LPC(0:0/20:4)
C28H50NO7P
543.6771
543.3325
LPC(0:0/20:4)
1-
602.3463
543.6771
543.3325
6
LPC(20:4/0:0)
C28H50NO7P
543.6771
543.3325
LPC(20:4/0:0)
1-
602.3463
543.6771
543.3325
6
LPC(0:0/20:3)
C28H52NO7P
545.6929
545.3481
LPC(0:0/20:3)
1-
604.3620
545.6929
545.3481
6
LPC(20:3/0:0)
C28H52NO7P
545.6929
545.3481
LPC(20:3/0:0)
1-
604.3620
545.6929
545.3481
6
LPC(0:0/22:6)
C30H50NO7P
567.6988
567.3325
LPC(0:0/22:6)
1-
626.3463
567.6988
567.3325
6
LPC(22:6/0:0)
C30H50NO7P
567.6988
567.3325
LPC(22:6/0:0)
1-
626.3463
567.6988
567.3325
6
LPC(0:0/22:5)
C30H52NO7P
569.7146
569.3481
LPC(0:0/22:5)
1-
628.3620
569.7146
569.3481
6
LPC(22:5/0:0)
C30H52NO7P
569.7146
569.3481
LPC(22:5/0:0)
1-
628.3620
569.7146
569.3481
6
LPE (Lyso phosphatidylethanolamine)
Molecule
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Precursor
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Q1 Z
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LPE(0:0/16:0)
C21H44NO7P
453.5535
453.2855
LPE(0:0/16:0)
1-
452.2783
453.5535
453.2855
7
LPE(16:0/0:0)
C21H44NO7P
453.5535
453.2855
LPE(16:0/0:0)
1-
452.2783
453.5535
453.2855
7
LPE(0:0/18:2)
C23H44NO7P
477.5752
477.2855
LPE(0:0/18:2)
1-
476.2783
477.5752
477.2855
7
LPE(18:2/0:0)
C23H44NO7P
477.5752
477.2855
LPE(18:2/0:0)
1-
476.2783
477.5752
477.2855
7
LPE(0:0/18:1)
C23H46NO7P
479.5911
479.3012
LPE(0:0/18:1)
1-
478.2939
479.5911
479.3012
7
LPE(18:1/0:0)
C23H46NO7P
479.5911
479.3012
LPE(18:1/0:0)
1-
478.2939
479.5911
479.3012
7
LPE(0:0/18:0)
C23H48NO7P
481.6069
481.3168
LPE(0:0/18:0)
1-
480.3096
481.6069
481.3168
7
LPE(18:0/0:0)
C23H48NO7P
481.6069
481.3168
LPE(18:0/0:0)
1-
480.3096
481.6069
481.3168
7
LPE(0:0/20:4)
C25H44NO7P
501.5969
501.2855
LPE(0:0/20:4)
1-
500.2783
501.5969
501.2855
7
LPE(20:4/0:0)
C25H44NO7P
501.5969
501.2855
LPE(20:4/0:0)
1-
500.2783
501.5969
501.2855
7
LPE(0:0/20:3)
C25H46NO7P
503.6128
503.3012
LPE(0:0/20:3)
1-
502.2939
503.6128
503.3012
7
LPE(20:3/0:0)
C25H46NO7P
503.6128
503.3012
LPE(20:3/0:0)
1-
502.2939
503.6128
503.3012
7
PA (Phosphatidic acid)
Molecule
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Precursor
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Q1 Z
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PA(16:0_18:1)
C37H71O8P
674.9342
674.4887
PA(16:0_18:1)
1-
673.4814
674.9342
674.4887
10
PC (Phosphatidylcholine)
Molecule
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Q1 Z
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PC(14:0_16:0)
C38H76NO8P
705.9914
705.5309
PC(14:0_16:0)
1-
764.5447
705.9914
705.5309
11
PC(13:0_18:1);PC(15:1_16:0)
C39H76NO8P
718.0023
717.5309
PC(13:0_18:1);PC(15:1_16:0)
1-
776.5447
718.0023
717.5309
17
PC(15:0_16:0)
C39H78NO8P
720.0181
719.5465
PC(15:0_16:0)
1-
778.5604
720.0181
719.5465
11
PC(14:0_18:2)
C40H76NO8P
730.0131
729.5309
PC(14:0_18:2)
1-
788.5447
730.0131
729.5309
11
PC(32:2)
C40H76NO8P
730.0131
729.5309
PC(32:2)
1-
788.5447
730.0131
729.5309
5
PC(16:0_16:1)
C40H78NO8P
732.0290
731.5465
PC(16:0_16:1)
1-
790.5604
732.0290
731.5465
11
PC(16:0/16:0)
C40H80NO8P
734.0449
733.5622
PC(16:0/16:0)
1-
792.5760
734.0449
733.5622
8
PC(13:0_20:4)
C41H74NO8P
740.0081
739.5152
PC(13:0_20:4)
1-
798.5291
740.0081
739.5152
11
PC(15:0_18:3)a
C41H76NO8P
742.0240
741.5309
PC(15:0_18:3)a
1-
800.5447
742.0240
741.5309
11
PC(15:0_18:3)b
C41H76NO8P
742.0240
741.5309
PC(15:0_18:3)b
1-
800.5447
742.0240
741.5309
11
PC(33:3)
C41H76NO8P
742.0240
741.5309
PC(33:3)
1-
800.5447
742.0240
741.5309
5
PC(15:0_18:2)
C41H78NO8P
744.0398
743.5465
PC(15:0_18:2)
1-
802.5604
744.0398
743.5465
11
PC(15:0_18:1);PC(16:0_17:1)
C41H80NO8P
746.0557
745.5622
PC(15:0_18:1);PC(16:0_17:1)
1-
804.5760
746.0557
745.5622
17
PC(14:0_20:4)
C42H76NO8P
754.0348
753.5309
PC(14:0_20:4)
1-
812.5447
754.0348
753.5309
11
PC(16:0_18:3)a
C42H78NO8P
756.0507
755.5465
PC(16:0_18:3)a
1-
814.5604
756.0507
755.5465
11
PC(16:0_18:3)b
C42H78NO8P
756.0507
755.5465
PC(16:0_18:3)b
1-
814.5604
756.0507
755.5465
11
PC(16:1_18:2)
C42H78NO8P
756.0507
755.5465
PC(16:1_18:2)
1-
814.5604
756.0507
755.5465
11
PC(16:0_18:2)
C42H80NO8P
758.0666
757.5622
PC(16:0_18:2)
1-
816.5760
758.0666
757.5622
11
PC(16:0_18:1)
C42H82NO8P
760.0824
759.5778
PC(16:0_18:1)
1-
818.5917
760.0824
759.5778
11
PC(16:0_18:0)
C42H84NO8P
762.0983
761.5935
PC(16:0_18:0)
1-
820.6073
762.0983
761.5935
11
PC(15:0_20:4)
C43H78NO8P
768.0615
767.5465
PC(15:0_20:4)
1-
826.5604
768.0615
767.5465
11
PC(17:1_18:1)
C43H82NO8P
772.0933
771.5778
PC(17:1_18:1)
1-
830.5917
772.0933
771.5778
11
PC(16:0_20:5)
C44H78NO8P
780.0724
779.5465
PC(16:0_20:5)
1-
838.5604
780.0724
779.5465
11
PC(16:1_20:4)
C44H78NO8P
780.0724
779.5465
PC(16:1_20:4)
1-
838.5604
780.0724
779.5465
11
PC(18:2_18:3)
C44H78NO8P
780.0724
779.5465
PC(18:2_18:3)
1-
838.5604
780.0724
779.5465
11
PC(16:0_20:4)
C44H80NO8P
782.0883
781.5622
PC(16:0_20:4)
1-
840.5760
782.0883
781.5622
11
PC(16:0_20:3)
C44H82NO8P
784.1041
783.5778
PC(16:0_20:3)
1-
842.5917
784.1041
783.5778
11
PC(18:0_18:3)
C44H82NO8P
784.1041
783.5778
PC(18:0_18:3)
1-
842.5917
784.1041
783.5778
11
PC(18:1_18:2)
C44H82NO8P
784.1041
783.5778
PC(18:1_18:2)
1-
842.5917
784.1041
783.5778
11
PC(18:0_18:2)
C44H84NO8P
786.1200
785.5935
PC(18:0_18:2)
1-
844.6073
786.1200
785.5935
11
PC(18:0_18:1)
C44H86NO8P
788.1359
787.6091
PC(18:0_18:1)
1-
846.6230
788.1359
787.6091
11
PC(15:0_22:6)
C45H78NO8P
792.0832
791.5465
PC(15:0_22:6)
1-
850.5604
792.0832
791.5465
11
PC(37:6)
C45H78NO8P
792.0832
791.5465
PC(37:6)
1-
850.5604
792.0832
791.5465
5
PC(15:0_22:5)
C45H80NO8P
794.0991
793.5622
PC(15:0_22:5)
1-
852.5760
794.0991
793.5622
11
PC(17:0_20:5)
C45H80NO8P
794.0991
793.5622
PC(17:0_20:5)
1-
852.5760
794.0991
793.5622
11
PC(17:0_20:3)
C45H84NO8P
798.1309
797.5935
PC(17:0_20:3)
1-
856.6073
798.1309
797.5935
11
PC(18:2_19:0)
C45H86NO8P
800.1468
799.6091
PC(18:2_19:0)
1-
858.6230
800.1468
799.6091
11
PC(17:0_20:2)
C45H86NO8P
800.1468
799.6091
PC(17:0_20:2)
1-
858.6230
800.1468
799.6091
11
PC(16:1_22:6)
C46H78NO8P
804.0941
803.5465
PC(16:1_22:6)
1-
862.5604
804.0941
803.5465
11
PC(18:2_20:4)
C46H80NO8P
806.1100
805.5622
PC(18:2_20:4)
1-
864.5760
806.1100
805.5622
11
PC(16:0_22:6)
C46H80NO8P
806.1100
805.5622
PC(16:0_22:6)
1-
864.5760
806.1100
805.5622
11
PC(16:0_22:5);PC(18:1_20:4)
C46H82NO8P
808.1258
807.5778
PC(16:0_22:5);PC(18:1_20:4)
1-
866.5917
808.1258
807.5778
17
PC(18:0_20:5)
C46H82NO8P
808.1258
807.5778
PC(18:0_20:5)
1-
866.5917
808.1258
807.5778
11
PC(16:0_22:4)
C46H84NO8P
810.1417
809.5935
PC(16:0_22:4)
1-
868.6073
810.1417
809.5935
11
PC(18:0_20:4)
C46H84NO8P
810.1417
809.5935
PC(18:0_20:4)
1-
868.6073
810.1417
809.5935
11
PC(18:0_20:3)
C46H86NO8P
812.1576
811.6091
PC(18:0_20:3)
1-
870.6230
812.1576
811.6091
11
PC(18:0_20:2)
C46H88NO8P
814.1735
813.6248
PC(18:0_20:2)
1-
872.6386
814.1735
813.6248
11
PC(19:0_20:4)
C47H86NO8P
824.1685
823.6091
PC(19:0_20:4)
1-
882.6230
824.1685
823.6091
11
PC(18:1_22:6)
C48H82NO8P
832.1475
831.5778
PC(18:1_22:6)
1-
890.5917
832.1475
831.5778
11
PC(18:0_22:6)
C48H84NO8P
834.1634
833.5935
PC(18:0_22:6)
1-
892.6073
834.1634
833.5935
11
PC(18:0_22:5)a
C48H86NO8P
836.1793
835.6091
PC(18:0_22:5)a
1-
894.6230
836.1793
835.6091
11
PC(18:0_22:5)b
C48H86NO8P
836.1793
835.6091
PC(18:0_22:5)b
1-
894.6230
836.1793
835.6091
11
PC(18:0_22:4)
C48H88NO8P
838.1952
837.6248
PC(18:0_22:4)
1-
896.6386
838.1952
837.6248
11
PC(20:4_22:6)
C50H80NO8P
854.1534
853.5622
PC(20:4_22:6)
1-
912.5760
854.1534
853.5622
11
PC(O/P-) (Akyl/alkenyl ether phosphatidylcholine)
Molecule
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Precursor
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Q1 Z
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Q1 m/z
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PC(P-16:0/17:2)
C41H78NO7P
728.0404
727.5516
PC(P-16:0/17:2)
1-
786.5654
728.0404
727.5516
10
PC(O-16:0/18:3);PC(P-16:0/18:2)
C42H80NO7P
742.0672
741.5672
PC(O-16:0/18:3);PC(P-16:0/18:2)
1-
800.5811
742.0672
741.5672
15
PC(O-16:0/18:2)
C42H82NO7P
744.0830
743.5829
PC(O-16:0/18:2)
1-
802.5967
744.0830
743.5829
10
PC(P-16:0/18:1)
C42H82NO7P
744.0830
743.5829
PC(P-16:0/18:1)
1-
802.5967
744.0830
743.5829
10
PC(P-18:0/16:0)
C42H84NO7P
746.0989
745.5985
PC(P-18:0/16:0)
1-
804.6124
746.0989
745.5985
10
PC(P-16:0/20:5)
C44H78NO7P
764.0730
763.5516
PC(P-16:0/20:5)
1-
822.5654
764.0730
763.5516
10
PC(P-16:0/20:4)
C44H80NO7P
766.0889
765.5672
PC(P-16:0/20:4)
1-
824.5811
766.0889
765.5672
10
PC(O-16:0/20:4);PC(P-18:0/18:3)
C44H82NO7P
768.1047
767.5829
PC(O-16:0/20:4);PC(P-18:0/18:3)
1-
826.5967
768.1047
767.5829
15
PC(O-16:0/20:3)
C44H84NO7P
770.1206
769.5985
PC(O-16:0/20:3)
1-
828.6124
770.1206
769.5985
10
PC(P-18:0/18:2)
C44H84NO7P
770.1206
769.5985
PC(P-18:0/18:2)
1-
828.6124
770.1206
769.5985
10
PC(O-16:0/22:6)
C46H82NO7P
792.1264
791.5829
PC(O-16:0/22:6)
1-
850.5967
792.1264
791.5829
10
PC(P-16:0/22:5)
C46H82NO7P
792.1264
791.5829
PC(P-16:0/22:5)
1-
850.5967
792.1264
791.5829
10
PC(O-16:0/22:5);PC(P-18:0/20:4)a
C46H84NO7P
794.1423
793.5985
PC(O-16:0/22:5);PC(P-18:0/20:4)a
1-
852.6124
794.1423
793.5985
15
PC(P-18:0/20:4)b
C46H84NO7P
794.1423
793.5985
PC(P-18:0/20:4)b
1-
852.6124
794.1423
793.5985
10
PC(O-18:0/20:4)
C46H86NO7P
796.1582
795.6142
PC(O-18:0/20:4)
1-
854.6280
796.1582
795.6142
10
PC(P-18:0/22:6)a
C48H84NO7P
818.1640
817.5985
PC(P-18:0/22:6)a
1-
876.6124
818.1640
817.5985
10
PC(P-18:0/22:6)b
C48H84NO7P
818.1640
817.5985
PC(P-18:0/22:6)b
1-
876.6124
818.1640
817.5985
10
PC(O-18:0/22:5)
C48H88NO7P
822.1958
821.6298
PC(O-18:0/22:5)
1-
880.6437
822.1958
821.6298
10
PC(O-18:0/22:4)
C48H90NO7P
824.2117
823.6455
PC(O-18:0/22:4)
1-
882.6593
824.2117
823.6455
9
PC(O-20:0/20:4)
C48H90NO7P
824.2117
823.6455
PC(O-20:0/20:4)
1-
882.6593
824.2117
823.6455
10
PC(O-20:0/22:6)
C50H90NO7P
848.2334
847.6455
PC(O-20:0/22:6)
1-
906.6593
848.2334
847.6455
10
PC(O-42:6);PC(P-42:5)
C50H90NO7P
848.2334
847.6455
PC(O-42:6);PC(P-42:5)
1-
906.6593
848.2334
847.6455
5
PE (Phosphatidylethanolamine)
Molecule
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Precursor
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Q1 Z
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Q1 m/z
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PE(32:1)a
C37H72NO8P
689.9488
689.4996
PE(32:1)a
1-
688.4923
689.9488
689.4996
5
PE(32:1)b
C37H72NO8P
689.9488
689.4996
PE(32:1)b
1-
688.4923
689.9488
689.4996
5
PE(16:0/16:0)
C37H74NO8P
691.9647
691.5152
PE(16:0/16:0)
1-
690.5079
691.9647
691.5152
8
PE(14:0_20:4)
C39H70NO8P
711.9546
711.4839
PE(14:0_20:4)
1-
710.4766
711.9546
711.4839
11
PE(16:0_18:3)a
C39H72NO8P
713.9705
713.4996
PE(16:0_18:3)a
1-
712.4923
713.9705
713.4996
11
PE(16:0_18:3)b
C39H72NO8P
713.9705
713.4996
PE(16:0_18:3)b
1-
712.4923
713.9705
713.4996
11
PE(16:0_18:2)
C39H74NO8P
715.9864
715.5152
PE(16:0_18:2)
1-
714.5079
715.9864
715.5152
11
PE(16:0_18:1)a
C39H76NO8P
718.0023
717.5309
PE(16:0_18:1)a
1-
716.5236
718.0023
717.5309
11
PE(16:0_18:1)b
C39H76NO8P
718.0023
717.5309
PE(16:0_18:1)b
1-
716.5236
718.0023
717.5309
11
PE(16:0_18:0)
C39H78NO8P
720.0181
719.5465
PE(16:0_18:0)
1-
718.5392
720.0181
719.5465
11
PE(35:1)
C40H78NO8P
732.0290
731.5465
PE(35:1)
1-
730.5392
732.0290
731.5465
5
PE(16:0_20:5)
C41H72NO8P
737.9922
737.4996
PE(16:0_20:5)
1-
736.4923
737.9922
737.4996
11
PE(36:5)
C41H72NO8P
737.9922
737.4996
PE(36:5)
1-
736.4923
737.9922
737.4996
5
PE(16:0_20:4);PE(18:2/18:2)
C41H74NO8P
740.0081
739.5152
PE(16:0_20:4);PE(18:2/18:2)
1-
738.5079
740.0081
739.5152
14
PE(18:0_18:3)a
C41H76NO8P
742.0240
741.5309
PE(18:0_18:3)a
1-
740.5236
742.0240
741.5309
11
PE(18:0_18:3)b
C41H76NO8P
742.0240
741.5309
PE(18:0_18:3)b
1-
740.5236
742.0240
741.5309
11
PE(18:1_18:2)
C41H76NO8P
742.0240
741.5309
PE(18:1_18:2)
1-
740.5236
742.0240
741.5309
11
PE(18:0_18:2)
C41H78NO8P
744.0398
743.5465
PE(18:0_18:2)
1-
742.5392
744.0398
743.5465
11
PE(18:1/18:1)
C41H78NO8P
744.0398
743.5465
PE(18:1/18:1)
1-
742.5392
744.0398
743.5465
8
PE(18:0_18:1)
C41H80NO8P
746.0557
745.5622
PE(18:0_18:1)
1-
744.5549
746.0557
745.5622
11
PE(36:1)
C41H80NO8P
746.0557
745.5622
PE(36:1)
1-
744.5549
746.0557
745.5622
5
PE(17:1_20:3)
C42H76NO8P
754.0348
753.5309
PE(17:1_20:3)
1-
752.5236
754.0348
753.5309
11
PE(37:1)a
C42H82NO8P
760.0824
759.5778
PE(37:1)a
1-
758.5705
760.0824
759.5778
5
PE(37:1)b
C42H82NO8P
760.0824
759.5778
PE(37:1)b
1-
758.5705
760.0824
759.5778
5
PE(16:0_22:6)
C43H74NO8P
764.0298
763.5152
PE(16:0_22:6)
1-
762.5079
764.0298
763.5152
11
PE(16:0_22:5);PE(18:1_20:4)a
C43H76NO8P
766.0457
765.5309
PE(16:0_22:5);PE(18:1_20:4)a
1-
764.5236
766.0457
765.5309
17
PE(16:0_22:5);PE(18:1_20:4)b
C43H76NO8P
766.0457
765.5309
PE(16:0_22:5);PE(18:1_20:4)b
1-
764.5236
766.0457
765.5309
17
PE(18:0_20:5)
C43H76NO8P
766.0457
765.5309
PE(18:0_20:5)
1-
764.5236
766.0457
765.5309
17
PE(18:0_20:4)
C43H78NO8P
768.0615
767.5465
PE(18:0_20:4)
1-
766.5392
768.0615
767.5465
11
PE(38:4)
C43H78NO8P
768.0615
767.5465
PE(38:4)
1-
766.5392
768.0615
767.5465
5
PE(18:0_20:3)
C43H80NO8P
770.0774
769.5622
PE(18:0_20:3)
1-
768.5549
770.0774
769.5622
11
PE(38:3)
C43H80NO8P
770.0774
769.5622
PE(38:3)
1-
768.5549
770.0774
769.5622
5
PE(18:0_20:2)
C43H82NO8P
772.0933
771.5778
PE(18:0_20:2)
1-
770.5705
772.0933
771.5778
11
PE(18:0_20:1)
C43H84NO8P
774.1092
773.5935
PE(18:0_20:1)
1-
772.5862
774.1092
773.5935
11
PE(17:0_22:6)
C44H76NO8P
778.0565
777.5309
PE(17:0_22:6)
1-
776.5236
778.0565
777.5309
11
PE(19:0_20:4)
C44H80NO8P
782.0883
781.5622
PE(19:0_20:4)
1-
780.5549
782.0883
781.5622
11
PE(19:0_20:2)
C44H84NO8P
786.1200
785.5935
PE(19:0_20:2)
1-
784.5862
786.1200
785.5935
11
PE(40:7)a
C45H76NO8P
790.0674
789.5309
PE(40:7)a
1-
788.5236
790.0674
789.5309
5
PE(40:7)b
C45H76NO8P
790.0674
789.5309
PE(40:7)b
1-
788.5236
790.0674
789.5309
5
PE(18:0_22:6)
C45H78NO8P
792.0832
791.5465
PE(18:0_22:6)
1-
790.5392
792.0832
791.5465
11
PE(18:0_22:5)a
C45H80NO8P
794.0991
793.5622
PE(18:0_22:5)a
1-
792.5549
794.0991
793.5622
11
PE(18:0_22:5)b
C45H80NO8P
794.0991
793.5622
PE(18:0_22:5)b
1-
792.5549
794.0991
793.5622
11
PE(20:0_20:2)
C45H86NO8P
800.1468
799.6091
PE(20:0_20:2)
1-
798.6018
800.1468
799.6091
11
PE(20:0_20:1)
C45H88NO8P
802.1626
801.6248
PE(20:0_20:1)
1-
800.6175
802.1626
801.6248
11