PC(20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
|
854.5679
|
8.37
|
− 1.8
|
C50H80NO8P
|
M + H, M + Na
|
2.3
|
↑
|
↓
|
↓
|
PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/16:1(9Z))
|
804.5511
|
8.41
|
− 3.4
|
C46H78NO8P
|
M + H, M + Na
|
3.2
|
↑
|
↑
|
↓
|
PC(20:5(5Z,8Z,11Z,14Z,17Z)/20:3(8Z,11Z,14Z))
|
830.5677
|
8.46
|
− 2.1
|
C48H80NO8P
|
M + H, M + Na
|
5.1
|
↑
|
↓
|
↓
|
PC(18:2(9Z,12Z)/16:0)
|
780.5509
|
8.94
|
− 0.6
|
C42H80NO8P
|
M + Na
|
1.5
|
↓
|
↓
|
↓
|
PC(16:0/18:1(9Z))
|
760.5842
|
9.20
|
− 1.1
|
C42H82NO8P
|
M + H
|
5.5
|
↓
|
↓
|
↓
|
Adenosine
|
268.1038
|
0.80
|
− 0.9
|
C10H13N5O4
|
M + H
|
1.0
|
↑
|
↓
|
↓
|
LysoPC(20:2(11Z,14Z))
|
548.3706
|
6.51
|
− 0.9
|
C28H54NO7P
|
M + H, M + Na
|
2.1
|
↑
|
↑
|
↑
|
LysoPC(15:0)
|
482.3241
|
7.02
|
− 0.1
|
C23H48NO7P
|
M + H, M + Na, 2M + H, 2M + Na
|
3.6
|
↓
|
↓
|
↑
|
SM(d18:1/24:1(15Z))
|
813.6857
|
10.05
|
1.6
|
C47H93N2O6P
|
M + H, M + Na
|
2.4
|
↓
|
↓
|
↓
|
Pantothenic acid
|
220.1178
|
1.67
|
− 0.8
|
C9H17NO5
|
M + H, M + Na
|
1.2
|
↑
|
↑
|
↑
|
Pyroglutamic acid
|
130.0498
|
1.15
|
− 0.6
|
C5H7NO3
|
M + H
|
1.1
|
↑
|
↓
|
↓
|
Pyrroline hydroxycarboxylic acid
|
130.0499
|
0.69
|
− 0.1
|
C5H7NO3
|
M + H
|
1.5
|
↑
|
↓
|
↓
|
Docosahexaenoic acid
|
329.2462
|
6.64
|
− 4.1
|
C22H32O2
|
M + H, M + NH4, M + Na
|
1.0
|
↓
|
↓
|
↓
|
Dipalmitoylphosphatidylcholine
|
734.5686
|
9.22
|
− 1.2
|
C40H80NO8P
|
M + H
|
2.3
|
↑
|
↓
|
↓
|
Glutathione
|
308.0906
|
0.77
|
− 1.5
|
C10H17N3O6S
|
M + H
|
8.8
|
↑
|
↑
|
↑
|
Oxidized glutathione
|
307.0833
|
0.69
|
0.0
|
C20H32N6O12S2
|
M + H, M + 2H
|
4.6
|
↑
|
↓
|
↓
|
Dioleoylphosphatidylcholine
|
786.5996
|
9.25
|
− 1.5
|
C44H84NO8P
|
M + H
|
6.0
|
↓
|
↓
|
↓
|
FAD
|
786.1630
|
1.70
|
− 1.8
|
C27H33N9O15P2
|
M + H
|
1.1
|
↑
|
↑
|
↓
|
Niacinamide
|
123.0553
|
0.67
|
0.1
|
C6H6N2O
|
M + H
|
1.2
|
↑
|
↓
|
↓
|
Pantetheine 4′-phosphate
|
359.1033
|
1.66
|
− 0.9
|
C11H23N2O7PS
|
M + H, M + Na, 2M + H, 2M + Na
|
2.7
|
↑
|
↑
|
↑
|
Inosine
|
267.0734
|
1.54
|
− 0.5
|
C10H12N4O5
|
M-H
|
3.9
|
↑
|
↓
|
↓
|
Glycerol 3-phosphate
|
171.0063
|
0.61
|
− 0.6
|
C3H9O6P
|
M-H
|
1.3
|
↑
|
↑
|
↑
|