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Return to study ST000818 main page
Analysis: C18 NEGATIVE ION MODE/QTOF
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
ALPHA-HYDROXYISOBUTYRIC ACID (M-H)-
2-Hydroxyisobutyric acid
ME219598
440873
-
1.765
104.0472
2-HYDROXYBUTYRIC ACID (M-H)-
2-Hydroxybutyric acid
ME219588
11266
-
1.796
104.0473
N-ACETYLGLYCINE (M-H)-
N-Acetylglycine
ME219647
1097
-
0.918
117.0422
METHYLMALONIC ACID (M-H)-
Methylmalonic acid
ME219641
487
-
1.5
118.0265
SUCCINIC ACID (M-H)-
Succinic acid
ME219663
1110
-
1.334
118.0265
2-HYDROXY-3-METHYLBUTYRIC ACID (M-H)-
2-Hydroxy-3-methylbutyric acid
ME219586
853180
-
3.562
118.0631
BENZOIC ACID (M-H)-
Benzoic acid
ME219603
243
-
5.046
122.0364
N-ETHYLMALEIMIDE (M-H)-
N-Ethylmaleimide
ME219649
4362
-
3.479
125.0475
2-METHYLMALEIC ACID (M-H)-
Citraconic acid
ME219589
643798
-
1.881
130.0263
ITACONIC ACID (M-H)-
Itaconic acid
ME219631
811
-
1.881
130.0263
3-METHYL-2-OXOPENTANOIC ACID (M-H)-
3-Methyl-2-oxovaleric acid
ME219593
440877
-
4.479
130.0633
4-METHYL-2-OXOPENTANOIC ACID (M-H)-
Ketoleucine
ME219594
70
-
4.888
130.0633
N-ACETYL-L-ALANINE (M-H)-
N-Acetylalanine
ME219646
88064
-
1.523
131.0577
ISOLEUCINE (M-H)-
Isoleucine
ME219630
6306
-
1.569
131.0935
LEUCINE (M-H)-
Leucine
ME219638
6106
-
1.57
131.0935
OXALOACETIC ACID (M-H)-[-H2O]
Oxaloacetic acid
ME219652
970
-
0.563
132.0035
GLUTARIC ACID (M-H)-
Glutaric acid
ME219624
743
-
2.089
132.0421
MALIC ACID (M-H)-
Malic acid
ME219640
222656
-
0.816
134.0218
L-[15N]ANTHRANILIC ACID [ISTD] (M-H)-
2-Aminobenzoic acid
ME219636
227
-
5.418
138.0446
ADIPIC ACID (M-H)-
Adipic acid
ME219597
196
-
3.647
146.0588
GLUTAMINE (M-H)-
Glutamine
ME219623
5961
-
0.621
146.0691
CITRAMALIC ACID (M-H)-
Citramalic acid
ME219608
441696
-
1.433
148.037
MEVALONIC ACID (M-H)-
Mevalonic acid
ME219642
439230
-
1.591
148.0721
2-HYDROXY-4-(METHYLTHIO)BUTYRIC ACID (M-H)-
2-Hydroxy-4-(methylthio)butanoic acid
ME219587
11427
-
3.399
150.0348
XANTHINE (M-H)-
Xanthine
ME219674
1188
-
1.285
152.0333
RIBITOL (M+Cl)-
Ribitol
ME219660
94154
-
0.658
152.0682
L-HISTIDINE (M-H)-
Histidine
ME219634
6274
-
0.61
155.0693
L-CARNITINE (M+Cl)-
Carnitine
ME219633
10917
-
0.644
161.1042
3-HYDROXY-3-METHYLGLUTARIC ACID (M-H)-
3-Hydroxymethylglutaric acid
ME219592
1662
-
1.594
162.0516
PHENYLPYRUVIC ACID (M-H)-
Phenylpyruvic acid
ME219658
997
-
5.527
164.0471
2-DEOXY-D-GLUCOSE (M+Cl)-
2-Deoxy-glucose
ME219585
439268
-
0.737
164.0687
PHENYLALANINE (M-H)-
Phenylalanine
ME219657
6140
-
2.517
165.0789
TEREPHTHALIC ACID (M-H)-
Terephthalic acid
ME219665
7489
-
5.784
166.0266
1-METHYLXANTHINE (M-H)-
1-Methylxanthine
ME219582
80220
-
2.561
166.0499
URIC ACID (M-H)-
Uric acid
ME219672
1175
-
0.99
168.0286
TRANS-ACONITIC ACID (M-H)-
trans-Aconitic acid
ME219668
444212
-
1.218
174.0167
CITRULLINE (M-H)-
Citrulline
ME219610
9750
-
0.645
175.095
HIPPURIC ACID (M-H)-
Hippuric acid
ME219627
464
-
4.895
179.0584
THEOPHYLLINE (M-H)-
Theophylline
ME219666
2153
-
4.489
180.064
GLUCOSE (M+Cl)-
Glucose
ME219622
5793
-
0.644
180.0642
TYROSINE (M-H)-
Tyrosine
ME219671
6057
-
1.312
181.0734
3-(4-HYDROXYPHENYL)LACTIC ACID (M-H)-
Hydroxyphenyllactic acid
ME219591
440177
-
3.885
182.0578
4-PYRIDOXIC ACID (M-H)-
4-Pyridoxic acid
ME219595
6723
-
1.912
183.0527
5-HYDROXYINDOLEACETIC ACID (M-H)-
5-Hydroxyindoleacetic acid
ME219596
1826
-
4.162
191.0605
N-ACETYL-DL-METHIONINE (M-H)-
N-Acetylmethionine
ME219645
448580
-
4.142
191.0606
CITRIC ACID (M-H)-
Citric acid
ME219609
311
-
1.039
192.0274
ISOCITRIC ACID (M-H)-
Isocitric acid
ME219629
5318532
-
0.806
192.0274
LAURIC ACID (M-H)-
Lauric acid
ME219637
3893
-
21.822
200.1776
TRYPTOPHAN (M-H)-
Tryptophan
ME219670
6305
-
3.615
204.09
L-TRYPTOPHAN-15N2 [ISTD] (M-H)-
Tryptophan
ME219635
16217285
-
3.615
206.0843
KYNURENINE (M-H)-
Kynurenine
ME219632
161166
-
2.184
208.0839
PANTOTHENIC ACID (M-H)-
Pantothenic acid
ME219656
6613
-
3.357
219.1103
ZEATIN [ISTD] (M+Cl)-
trans-Zeatin
ME219675
449093
-
3.896
219.112
ZEATIN [ISTD] (M-H)-
trans-Zeatin
ME219676
449093
-
3.896
219.112
MYRISTOLEIC ACID (M-H)-
Myristoleic acid
ME219644
5281119
-
22.108
226.1932
DEOXYURIDINE (M+Cl)-
Deoxyuridine
ME219614
13712
-
1.686
228.0744
MYRISTIC ACID (M-H)-
Myristic acid
ME219643
11005
-
22.492
228.2089
URIDINE (M+Cl)-
Uridine
ME219673
6029
-
1.379
244.0694
DEOXYADENOSINE (M+Cl)-
Deoxyadenosine
ME219611
13730
-
1.842
251.1023
PALMITOLEIC ACID (M-H)-
Palmitoleic acid
ME219655
445638
-
22.62
254.2247
PALMITIC ACID (M-H)-
Palmitic acid
ME219654
985
-
22.881
256.2408
HEPTADECANOIC ACID (M-H)-
Margaric acid
ME219626
10465
-
23.049
270.2558
LINOLEIC ACID (M-H)-
Linoleic acid
ME219639
5280450
-
22.757
280.2408
CIS-VACCENIC ACID (M-H)-
cis-Vaccenic acid
ME219607
5282761
-
22.964
282.2564
ELAIDIC ACID (M-H)-
Elaidic acid
ME219618
637517
-
22.964
282.2564
OLEIC ACID (M-H)-
Oleic acid
ME219651
445639
-
22.963
282.2564
TRANS-VACCENIC ACID (M-H)-
trans-Vaccenic acid
ME219669
5281127
-
22.963
282.2564
STEARIC ACID (M-H)-
Stearic acid
ME219662
5281
-
23.234
284.272
EDTA (M-H)-
Edetic acid
ME219617
6049
-
1.147
292.0912
ARACHIDONATE #2 (M-H)-
Arachidonic acid
ME219600
444899
-
22.817
304.2406
ARACHIDONIC ACID (M-H)-
Arachidonic acid
ME219601
444899
-
22.743
304.2408
N-ACETYLNEURAMINIC ACID (M-H)-
N-Acetylneuraminic acid
ME219648
444885
-
0.681
309.1075
CIS-11-EICOSENOIC ACID (M-H)-
cis-Gondoic acid
ME219606
5282768
-
23.313
310.287
PHYTANIC ACID (M-H)-
Phytanic acid
ME219659
10380830
-
23.325
312.3022
ARACHIDIC ACID (M-H)-
Arachidic acid
ME219599
10467
-
23.668
312.3024
P-ACETAMIDOPHENYL BETA-D-GLUCURONIDE (M-H)-
p-Acetamidophenylglucuronide
ME219653
83944
-
2.282
327.0954
DOCOSAHEXAENOIC ACID (M-H)-
Docosahexaenoic acid
ME219616
445580
-
22.734
328.241
ERUCIC ACID (M-H)-
cis-Erucic acid
ME219620
5281116
-
23.729
338.3183
BEHENIC ACID (M-H)-
Behenic acid
ME219602
8215
-
24.2
340.334
SUCROSE (M+Cl)-
Sucrose
ME219664
5988
-
0.68
342.1169
NERVONIC ACID (M-H)-
Nervonic acid
ME219650
5281120
-
24.272
366.3497
S-ADENOSYL-L-HOMOCYSTEINE (M-H)-
S-Adenosylhomocysteine
ME219661
439155
-
1.542
384.1194
DEOXYCHOLIC ACID (M-H)-
Deoxycholic acid
ME219613
222528
-
21.781
392.2919
DEOXYCHOLIC ACID (M+Cl)-
Deoxycholic acid
ME219612
222528
-
21.765
392.2925
HYODEOXYCHOLIC ACID (M-H)-
Hyodeoxycholic acid
ME219628
5283820
-
22.877
392.2946
GLYCOLITHOCHOLIC ACID (M-H)-
Glycolithocholic acid
ME219625
115245
-
21.656
433.3188
GERANYLGERANYL DIPHOSPHATE (M-H)-
Geranylgeranyl diphosphate
ME219621
447277
-
23.242
450.1902
EPIBRASSINOLIDE [ISTD] (M+Cl)-
24-epi-Brassinolide
ME219619
115196
-
19.979
480.345
18:0 LYSO-PE (M-H)-
LPE 18:0
ME219584
9547068
-
22.659
481.3173
16:0 LYSO PC (M+Cl)-
LPC 16:0
ME219583
460602
-
22.259
495.3328
BILIVERDIN (M-H)-
Biliverdin
ME219604
5280353
-
18.666
582.2473
C12 GALACTOSYL(BETA) CERAMIDE (D18:1/12:0) (M+Cl)-
-
ME219605
46891735
-
23.292
643.5008
DIPALMITOYL PHOSPHATIDYLETHANOLAMINE (M-H)-
PE 16:0/16:0
ME219615
445468
-
24.728
691.5168
THYROXINE (M-H)-
Thyroxine
ME219667
5819
-
16.278
776.6864
24:0 SM (D18:1/24:0) (M+Cl)-
SM 18:1;O2/24:0
ME219590
44260127
-
27.884
814.6925
Analysis: C18 POSITIVE ION MODE/QTOF
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
CHOLINE M+
Choline
ME219717
305
-
0.607
104.1075
CREATININE (M+H)+
Creatinine
ME219720
588
-
0.678
113.0582
PROLINE (M+H)+
Proline
ME219792
145742
-
0.684
115.0623
PROLINE (M+Na)+
Proline
ME219793
145742
-
0.669
115.0623
TRANS-CYCLOHEXANE-1,2-DIOL (M+Na)+
trans-Cyclohexane-1,2-diol
ME219812
92886
-
3.834
116.0836
VALINE (M+Na)+
Valine
ME219821
6287
-
0.862
117.0778
5-AMINOPENTANOIC ACID (M+H)+
5-Aminopentanoic acid
ME219698
138
-
0.734
117.0781
VALINE (M+H)+
Valine
ME219820
6287
-
0.867
117.0791
THREONINE (M+H)+[-H2O]
Threonine
ME219810
6288
-
0.947
119.0568
3-HYDROXYBENZALDEHYDE (M+H)+[-H2O]
3-Hydroxybenzaldehyde
ME219693
101
-
4.884
122.0369
N-CYCLOHEXYLFORMAMIDE (M+H)+
N-Cyclohexylformamide
ME219773
13017
-
8.023
127.0995
PIPECOLIC ACID (M+H)+
Pipecolic acid
ME219791
849
-
0.924
129.078
CREATINE (M+H)+
Creatine
ME219719
586
-
0.677
131.0686
ISOLEUCINE (M+Na)+
Isoleucine
ME219751
6306
-
1.512
131.093
LEUCINE (M+Na)+
Leucine
ME219761
6106
-
1.512
131.093
ISOLEUCINE (M+H)+
Isoleucine
ME219750
6306
-
1.528
131.0947
LEUCINE (M+H)+
Leucine
ME219760
6106
-
1.561
131.0947
ASPARAGINE (M+H)+
Asparagine
ME219706
6267
-
0.641
132.0514
ORNITHINE (M+H)+
Ornithine
ME219783
6262
-
0.506
132.0897
SPERMIDINE (M+H)+
Spermidine
ME219800
1102
-
0.512
145.1577
LYSINE (M+Na)+
Lysine
ME219765
5962
-
0.543
146.105
LYSINE (M+H)+
Lysine
ME219764
5962
-
0.506
146.1055
N-ACETYL-DL-SERINE (M+H)+[-H2O]
N-Acetylserine
ME219771
65249
-
0.878
147.0525
METHIONINE (M+H)+
Methionine
ME219766
6137
-
0.968
149.0505
ACETAMINOPHEN (TN TYLENOL) (M+Na)+
Acetaminophen
ME219702
1983
-
3.004
151.0633
ACETAMINOPHEN (TN TYLENOL) (M+H)+
Acetaminophen
ME219701
1983
-
3.103
151.0634
2',4'-DIHYDROXYACETOPHENONE (M+H)+
2',4'-Dihydroxyacetophenone
ME219685
6990
-
7.617
152.048
INDOLE-3-ACETALDEHYDE (M+H)+
Indoleacetaldehyde
ME219748
800
-
1.727
159.0673
CARNITINE (M+H)+
Carnitine
ME219712
10917
-
0.618
161.1048
2-DEOXY-D-GLUCOSE (M+Na)+
2-Deoxy-glucose
ME219686
439268
-
0.678
164.0683
PHENYLALANINE (M+H)+
Phenylalanine
ME219790
6140
-
2.413
165.0781
1-METHYLXANTHINE (M+H)+
1-Methylxanthine
ME219678
80220
-
2.511
166.0483
1-METHYLXANTHINE (M+Na)+
1-Methylxanthine
ME219679
80220
-
2.51
166.0494
PYRIDOXAL (M+H)+[-H2O]
Pyridoxal
ME219795
1050
-
0.968
167.0606
URIC ACID (M+H)+
Uric acid
ME219817
1175
-
1.004
168.0283
HOMOGENTISIC ACID (M+H)+
Homogentisic acid
ME219746
780
-
2.122
168.0397
PYRIDOXAMINE (M+H)+
Pyridoxamine
ME219796
1052
-
0.543
168.0869
4-QUINOLINECARBOXYLIC ACID #2 (M+H)+
4-Quinolinecarboxylic acid
ME219696
10243
-
5.032
173.047
L-ARGININE (M+H)+
Arginine
ME219755
6322
-
0.602
174.1106
L-ARGININE (M+Na)+
Arginine
ME219756
6322
-
0.588
174.1118
SEROTONIN (M+Na)+
Serotonin
ME219798
5202
-
1.635
176.0948
SEROTONIN (M+H)+
Serotonin
ME219797
5202
-
1.632
176.0953
HIPPURIC ACID (M+H)+
Hippuric acid
ME219744
464
-
4.884
179.0587
HIPPURIC ACID (M+Na)+
Hippuric acid
ME219745
464
-
4.884
179.0587
L-METHIONINE SULFOXIMINE (M+Na)+
Methionine sulfoximine
ME219757
89034
-
0.638
180.06
GLUCOSE (M+Na)+
Glucose
ME219736
5793
-
0.731
180.063
THEOBROMINE (M+H)+
Theobromine
ME219807
5429
-
3.511
180.0647
THEOPHYLLINE (M+H)+
Theophylline
ME219808
2153
-
4.314
180.0651
THEOPHYLLINE (M+Na)+
Theophylline
ME219809
2153
-
4.412
180.0651
TYROSINE (M+Na)+
Tyrosine
ME219816
6057
-
1.304
181.0727
TYROSINE (M+H)+
Tyrosine
ME219815
6057
-
1.303
181.0738
HOMOVANILLIC ACID (M+H)+
Homovanillic acid
ME219747
1738
-
5.825
182.0552
3-(4-HYDROXYPHENYL)LACTIC ACID (M+Na)+
Hydroxyphenyllactic acid
ME219692
440177
-
3.889
182.058
N6,N6,N6-TRIMETHYL-L-LYSINE (M+H)+
N-6-Trimethyllysine
ME219774
440120
-
0.595
188.1521
LL-2,6-DIAMINOHEPTANEDIOIC ACID (M+H)+[-H2O]
2,6-Diaminopimelic acid
ME219763
99290
-
0.674
190.0944
N-ACETYL-DL-METHIONINE (M+Na)+
N-Acetylmethionine
ME219770
448580
-
4.138
191.0615
5-HYDROXYINDOLEACETIC ACID (M+Na)+
5-Hydroxyindoleacetic acid
ME219699
1826
-
4.149
191.0616
CITRIC ACID (M+Na)+
Citric acid
ME219718
311
-
1.035
192.0278
TRANS-3'-HYDROXYCOTININE (M+H)+
trans-3-Hydroxycotinine
ME219811
107963
-
1.009
192.0897
METHYL BETA-D-GALACTOSIDE (M+Na)+
Methyl beta-D-galactoside
ME219767
94214
-
0.688
194.0805
CAFFEINE (M+H)+
Caffeine
ME219710
2519
-
5.969
194.0816
ACETYLCARNITINE (M+H)+
CAR 2:0
ME219703
18230
-
0.894
203.1152
TRYPTOPHAN (M+Na)+
Tryptophan
ME219814
6305
-
3.604
204.0883
TRYPTOPHAN (M+H)+
Tryptophan
ME219813
6305
-
3.606
204.0902
L-TRYPTOPHAN-15N2 [ISTD] (M+H)+
Tryptophan
ME219758
16217285
-
3.606
206.085
KYNURENINE (M+Na)+
Kynurenine
ME219754
161166
-
2.167
208.0841
KYNURENINE (M+H)+
Kynurenine
ME219753
161166
-
2.177
208.0847
3-METHOXYTYROSINE (M+H)+
3-Methoxytyrosine
ME219695
9307
-
2
211.0845
PROPIONYLCARNITINE (*) (M+H)+
CAR 3:0
ME219794
107738
-
1.591
217.1313
PANTOTHENIC ACID (M+H)+
Pantothenic acid
ME219788
6613
-
3.332
219.1098
PANTOTHENIC ACID (M+Na)+
Pantothenic acid
ME219789
6613
-
3.349
219.1108
ZEATIN [ISTD] (M+H)+
trans-Zeatin
ME219823
449093
-
3.888
219.1126
5-HYDROXYTRYPTOPHAN (M+H)+
5-Hydroxy-tryptophan
ME219700
439280
-
1.777
220.0829
CYSTATHIONINE (M+H)+
Cystathionine
ME219721
439258
-
0.627
222.065
METHYL JASMONATE (M+Na)+
Methyl jasmonate
ME219768
5281929
-
16
224.1418
CARNOSINE (M+Na)+
Carnosine
ME219714
439224
-
0.653
226.1061
CARNOSINE (M+H)+
Carnosine
ME219713
439224
-
0.668
226.1083
ISO-BUTYRYLCARNITINE (*) (M+H)+
CAR 3:0;2Me
ME219749
168379
-
2.79
231.1469
BUTYRYLCARNITINE (*) (M+H)+
CAR 4:0
ME219709
213144
-
2.872
231.147
URIDINE (M+Na)+
Uridine
ME219818
6029
-
1.367
244.0689
ISOVALERYLCARNITINE (*) (M+H)+
CAR 4:0;3Me
ME219752
169235
-
4.535
245.1629
SN-GLYCERO-3-PHOSPHOCHOLINE (M+H)+
sn-Glycero-3-phosphocholine
ME219799
439285
-
0.696
257.1009
HEXANOYLCARNITINE (*) M+
CAR 6:0
ME219743
3246939
-
6.976
260.1866
GLUTARYLCARNITINE (*) (M+H)+
CAR DC5:0
ME219737
53481622
-
1.88
275.1374
ALPHA-LINOLENIC ACID (M+Na)+
alpha-Linolenic acid
ME219704
5280934
-
22.866
278.2226
GAMMA-LINOLENIC ACID (M+Na)+
gamma-Linolenic acid
ME219735
5280933
-
22.866
278.2226
1-METHYLADENOSINE (M+H)+
1-Methyladenosine
ME219677
27476
-
3.055
281.1124
OLEAMIDE (M+Na)+
Oleamide
ME219778
5283387
-
22.629
281.2717
OLEAMIDE (M+H)+
Oleamide
ME219777
5283387
-
22.629
281.2718
OLEIC ACID (M+Na)+
Oleic acid
ME219780
445639
-
22.55
282.2546
ELAIDIC ACID (M+Na)+
Elaidic acid
ME219732
637517
-
22.92
282.2551
OLEIC ACID (M+H)+
Oleic acid
ME219779
445639
-
22.546
282.2559
ELAIDIC ACID (M+H)+
Elaidic acid
ME219731
637517
-
22.951
282.2567
XANTHOSINE (M+H)+
Xanthosine
ME219822
64959
-
2.343
284.0761
OCTENOYLCARNITINE (*) M+
CAR 8:1
ME219776
71464472
-
9.524
286.2024
OCTANOYLCARNITINE (*) (M+H)+
CAR 8:0
ME219775
123701
-
11.63
287.2102
5'-METHYLTHIOADENOSINE (M+H)+
5'-Methylthioadenosine
ME219697
439176
-
4.508
297.0885
SPHINGOSINE (M+H)+[-H2O]
Sphingosine
ME219803
5280335
-
20.287
299.28
SPHINGOSINE (M+H)+
Sphingosine
ME219802
5280335
-
20.287
299.2825
SPHINGANINE (M+H)+
Sphinganine
ME219801
644260
-
20.736
301.2962
GLYCEROL MYRISTATE (M+Na)+
MG 14:0
ME219738
79050
-
22.189
302.2444
DUMP (M+H)+
dUMP
ME219727
65063
-
0.964
308.0416
N-ACETYLNEURAMINIC ACID (M+H)+
N-Acetylneuraminic acid
ME219772
444885
-
0.643
309.1024
DECENOYLCARNITINE (*) (M+H)+
CAR 10:1
ME219724
57357170
-
13.874
313.2259
DECANOYLCARNITINE (*) (M+H)+
CAR 10:0
ME219723
11953821
-
15.22
315.2418
P-ACETAMIDOPHENYL BETA-D-GLUCURONIDE (M+Na)+
p-Acetamidophenylglucuronide
ME219785
83944
-
2.273
327.096
P-ACETAMIDOPHENYL BETA-D-GLUCURONIDE (M+H)+
p-Acetamidophenylglucuronide
ME219784
83944
-
2.274
327.0966
DODECENOYLCARNITINE (*) II M+
CAR 12:1
ME219725
53481671
-
16.656
342.2646
DODECENOYLCARNITINE (*) M+
CAR 12:1
ME219726
53481671
-
16.469
342.2648
LAUROYLCARNITINE (M+H)+
CAR 12:0
ME219759
168381
-
17.814
343.2727
OLEOYL-GLYCEROL (M+Na)+
MG 18:1
ME219781
5319879
-
22.73
356.2931
3-HYDROXYLAUROYLCARNITINE (*) (M+H)+
CAR 12:0;OH
ME219694
71464535
-
16.125
359.2676
TETRADECADIENOYLCARNITINE (*) M+
CAR 14:2
ME219805
53481681
-
17.741
368.2803
TETRADECENOYLCARNITINE (*) M+
CAR 14:1
ME219806
22833575
-
18.841
370.2966
MYRISTOYLCARNITINE (*) (M+H)+
CAR 14:0
ME219769
3413344
-
19.75
371.3041
CHOLESTEROL (M+H)+[-H2O]
Cholesterol
ME219715
5997
-
24.682
386.3554
BIS(2-ETHYLHEXYL)PHTHALIC ACID (M+H)+
bis(2-Ethylhexyl)phthalic acid
ME219707
8343
-
23.112
390.2781
BIS(2-ETHYLHEXYL)PHTHALIC ACID (M+Na)+
bis(2-Ethylhexyl)phthalic acid
ME219708
8343
-
23.114
390.2781
URSODIOL (M+H)+[-H2O]
Ursodeoxycholic acid
ME219819
31401
-
21.698
392.2898
PALMITOLEYLCARNITINE (*) M+
CAR 16:1
ME219786
71464547
-
20.312
398.3271
PALMITOYLCARNITINE (M+H)+
CAR 16:0
ME219787
11953816
-
21.189
399.3358
CALCIDIOL (M+H)+[-H2O]
25-Hydroxyvitamin D3
ME219711
5283731
-
22.601
400.3306
25-HYDROXYCHOLESTEROL (M+H)+[-H2O]
25-Hydroxycholesterol
ME219691
65094
-
22.819
402.3449
EICOSATRIENOYLCARNITINE (*) M+
CAR 20:3
ME219729
87076458
-
21.189
422.3228
LINOLEOYLCARNITINE (*) (M+H)+
CAR 18:2
ME219762
6450015
-
20.862
423.3355
OLEOYLCARNITINE (*) (M+H)+
CAR 18:1
ME219782
6441392
-
21.408
425.3518
STEAROYLCARNITINE (*) (M+H)+
CAR 18:0
ME219804
52922056
-
21.749
427.3675
ALPHA-TOCOPHEROL (M+H)+
alpha-Tocopherol
ME219705
14985
-
24.588
430.3801
GLYCOCHENODEOXYCHOLIC ACID (M+H)+
Glycochenodeoxycholic acid
ME219739
9548796
-
20.495
449.3131
GLYCOCHENODEOXYCHOLIC ACID (M+Na)+
Glycochenodeoxycholic acid
ME219741
9548796
-
20.498
449.3146
GLYCOCHENODEOXYCHOLIC ACID (M+H)+[-H2O]
Glycochenodeoxycholic acid
ME219740
9548796
-
20.486
449.3149
EICOSENOYLCARNITINE (*) (M+H)+
CAR 20:1
ME219730
71464507
-
21.832
453.3789
EICOSANOYLCARNITINE (*) (M+H)+
CAR 20:0
ME219728
53477833
-
22.053
455.397
GLYCOCHOLIC ACID (M+H)+[-H2O]
Glycocholic acid
ME219742
10140
-
18.851
465.3089
CHOLESTEROL HYDROGEN SULFATE M+[-HSO4]
Cholesterol sulfate
ME219716
65076
-
23.895
466.3101
EPIBRASSINOLIDE [ISTD] (M+Na)+
24-epi-Brassinolide
ME219734
115196
-
20.02
480.3462
EPIBRASSINOLIDE [ISTD] (M+H)+
24-epi-Brassinolide
ME219733
115196
-
20.021
480.3464
18:0 LYSO-PE (M+H)+
LPE 18:0
ME219683
9547068
-
22.694
481.3183
18:0 LYSO-PE (M+Na)+
LPE 18:0
ME219684
9547068
-
22.701
481.3218
CYTIDINE 5'-DIPHOSPHOCHOLINE (M+Na)+
CDP-choline
ME219722
13804
-
0.702
488.1144
16:0 LYSO PC (M+H)+
LPC 16:0
ME219680
460602
-
22.267
495.3338
16:0 LYSO PC (M+Na)+
LPC 16:0
ME219681
460602
-
22.27
495.3339
20:0 LYSO PC (M+H)+
LPC 20:0
ME219687
24779473
-
22.962
551.396
20:0 LYSO PC (M+Na)+
LPC 20:0
ME219688
24779473
-
22.959
551.3968
16:0-18:0 PC (M+H)+
PC 16:0_18:0
ME219682
18631368
-
25.507
761.5948
24:0 SM (D18:1/24:0) (M+H)+
SM 18:1;O2/24:0
ME219689
44260127
-
27.898
814.6938
24:0 SM (D18:1/24:0) (M+Na)+
SM 18:1;O2/24:0
ME219690
44260127
-
27.904
814.6939
Analysis: C18 NEGATIVE ION MODE/Triple TOF
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
CerP 34:1; [M-H]-@5.78
CerP 34:1;O2
ME219831
-
-
5.78
-
CL 70:5; [M-2H](2-)@5.87
CL 70:5
ME219824
-
-
5.87
-
CL 72:3; [M-2H](2-)@6.59
CL 72:3
ME219825
-
-
6.59
-
CL 74:5; [M-2H](2-)@5.76
CL 74:5
ME219826
-
-
5.76
-
CL 74:9; [M-2H](2-)@5.81
CL 74:9
ME219827
-
-
5.81
-
CL 78:3; [M-2H](2-)@7.47
CL 78:3
ME219828
-
-
7.47
-
CL 82:13; [M-2H](2-)@6.35
CL 82:13
ME219829
-
-
6.35
-
CL 82:15; [M-2H](2-)@5.92
CL 82:15
ME219830
-
-
5.92
-
FFA(16:0)
Palmitic acid
ME219832
-
-
-
-
FFA(18:0)
Stearic acid
ME219833
5281
-
-
-
FFA(18:1)
Octadecenoic acid
ME219834
-
-
-
-
FFA(18:2)
Octadecadienoic acid
ME219835
-
-
-
-
FFA(20:0)
Arachidic acid
ME219836
10467
-
-
-
FFA(20:1)
Heneicosenoic acid
ME219837
-
-
-
-
FFA(20:2)
Eicosadienoic acid
ME219838
-
-
-
-
FFA(20:4) Arachidonic acid
Arachidonic acid
ME219839
-
-
-
-
FFA(22:0)
Behenic acid
ME219840
8215
-
-
-
FFA(22:1)
Docosenoic acid
ME219841
-
-
-
-
FFA(22:2)
Docosadienoic acid
ME219842
-
-
-
-
FFA(22:3)
Docosatrienoic acid
ME219843
-
-
-
-
FFA(24:0)
Lignoceric acid
ME219844
11197
-
-
-
FFA(24:1)
Tetracosenoic acid
ME219845
-
-
-
-
FFA(24:2)
Tetracosadienoic acid
ME219846
-
-
-
-
FFA(24:3)
Tetracosatrienoic acid
ME219847
52921854
-
-
-
lysoPE 16:0; [M-H]-@1.61
LPE 16:0
ME219919
-
-
1.61
-
lysoPE 17:0; [M-H]-@1.99
LPE 17:0
ME219920
52925149
-
1.99
-
lysoPE 18:0; [M-H]-@2.37
LPE 18:0
ME219921
-
-
2.37
-
lysoPE 18:1; [M-H]-@1.78
LPE 18:1
ME219922
-
-
1.78
-
lysoPE 18:2; [M-H]-@1.33
LPE 18:2
ME219923
-
-
1.33
-
lysoPE 20:3; [M-H]-@1.59
LPE 20:3
ME219924
-
-
1.59
-
lysoPE 20:4; [M-H]-@1.31
LPE 20:4
ME219925
-
-
1.31
-
lysoPE 20:5; [M-H]-@1.04
LPE 20:5
ME219926
-
-
1.04
-
lysoPE 22:4; [M-H]-@1.84
LPE 22:4
ME219927
-
-
1.84
-
lysoPE 22:5; [M-H]-@1.50
LPE 22:5
ME219928
-
-
1.5
-
lysoPE 22:6; [M-H]-@1.26
LPE 22:6
ME219929
-
-
1.26
-
N-(15Z-tetracosenoyl)-sphing-4-enine; [M-H]-@8.46
Cer 18:1;O2/24:1
ME219848
5283568
-
8.46
-
N-(docosanoyl)-sphing-4-enine; [M-H]-@8.44
Cer 18:1;O2/22:0
ME219849
5283567
-
8.44
-
N-(hexadecanoyl)-sphing-4-enine; [M-H]-@6.82
Cer 18:1;O2/16:0
ME219850
5283564
-
6.82
-
N-(tetracosanoyl)-sphing-4-enine; [M-H]-@8.90
Cer 18:1;O2/24:0
ME219851
5283571
-
8.9
-
PA 32:1; [M-H]-@6.01
PA 32:1
ME219852
-
-
6.01
-
PA 34:2; [M-H]-@6.20
PA 34:2
ME219853
-
-
6.2
-
PC 19:2; [M-Ac-H]-@1.31
PC 19:2
ME219854
-
-
1.31
-
PC 30:1; [M-Ac-H]-@5.36
PC 30:1
ME219855
-
-
5.36
-
PC 31:0; [M-Ac-H]-@6.16
PC 31:0
ME219856
-
-
6.16
-
PC 32:0; [M-Ac-H]-@6.53
PC 32:0
ME219857
-
-
6.53
-
PC 33:1; [M-Ac-H]-@6.37
PC 33:1
ME219858
-
-
6.37
-
PC 33:2; [M-Ac-H]-@5.90
PC 33:2
ME219859
-
-
5.9
-
PC 34:4; [M-Ac-H]-@5.47
PC 34:4
ME219860
-
-
5.47
-
PC 35:1; [M-Ac-H]-@6.93
PC 35:1
ME219861
-
-
6.93
-
PC 37:1; [M-Ac-H]-@7.44
PC 37:1
ME219862
-
-
7.44
-
PC 37:2; [M-Ac-H]-@7.10
PC 37:2
ME219863
-
-
7.1
-
PC 37:4; [M-Ac-H]-@6.45
PC 37:4
ME219864
-
-
6.45
-
PC 39:4; [M-Ac-H]-@7.08
PC 39:4
ME219865
-
-
7.08
-
PC 40:5; [M-Ac-H]-@7.09
PC 40:5
ME219866
-
-
7.09
-
PC 42:10; [M-Ac-H]-@5.66
PC 42:10
ME219867
-
-
5.66
-
PE 30:0; [M-H]-@6.03
PE 30:0
ME219868
-
-
6.03
-
PE 32:1; [M-H]-@6.18
PE 32:1
ME219869
-
-
6.18
-
PE 33:1; [M-H]-@6.50
PE 33:1
ME219870
-
-
6.5
-
PE 33:2; [M-H]-@6.02
PE 33:2
ME219871
-
-
6.02
-
PE 34:1; [M-H]-@6.80
PE 34:1
ME219872
-
-
6.8
-
PE 34:2; [M-H]-@6.34
PE 34:2
ME219873
-
-
6.34
-
PE 34:3; [M-H]-@5.93
PE 34:3
ME219874
-
-
5.93
-
PE 35:0; [M-H]-@7.52
PE 35:0
ME219875
-
-
7.52
-
PE 35:1; [M-H]-@7.05
PE 35:1
ME219876
-
-
7.05
-
PE 35:2; [M-H]-@6.63
PE 35:2
ME219877
-
-
6.63
-
PE 35:4; [M-H]-@6.01
PE 35:4
ME219878
-
-
6.01
-
PE 36:1; [M-H]-@7.36
PE 36:1
ME219879
-
-
7.36
-
PE 36:2; [M-H]-@6.92
PE 36:2
ME219880
-
-
6.92
-
PE 36:3; [M-H]-@6.49
PE 36:3
ME219881
-
-
6.49
-
PE 36:4; [M-H]-@6.15
PE 36:4
ME219882
-
-
6.15
-
PE 36:5; [M-H]-@5.90
PE 36:5
ME219883
-
-
5.9
-
PE 37:3; [M-H]-@6.84
PE 37:3
ME219884
-
-
6.84
-
PE 37:4; [M-H]-@6.62
PE 37:4
ME219885
-
-
6.62
-
PE 37:5; [M-H]-@6.13
PE 37:5
ME219886
-
-
6.13
-
PE 37:6; [M-H]-@5.89
PE 37:6
ME219887
-
-
5.89
-
PE 38:1; [M-H]-@7.82
PE 38:1
ME219888
-
-
7.82
-
PE 38:3; [M-H]-@7.21
PE 38:3
ME219889
-
-
7.21
-
PE 38:4; [M-H]-@6.87
PE 38:4
ME219890
-
-
6.87
-
PE 38:5; [M-H]-@6.50
PE 38:5
ME219891
-
-
6.5
-
PE 38:6; [M-H]-@6.07
PE 38:6
ME219892
-
-
6.07
-
PE 38:7; [M-H]-@5.78
PE 38:7
ME219893
-
-
5.78
-
PE 40:4; [M-H]-@7.35
PE 40:4
ME219894
-
-
7.35
-
PE 40:5; [M-H]-@6.32
PE 40:5
ME219895
-
-
7.05
-
PE 40:5; [M-H]-@7.05
PE 40:5
ME219896
-
-
7.05
-
PE 40:6; [M-H]-@6.83
PE 40:6
ME219897
-
-
6.83
-
PE 40:7; [M-H]-@6.30
PE 40:7
ME219898
-
-
6.3
-
PE 40:8; [M-H]-@5.93
PE 40:8
ME219899
-
-
5.93
-
PG 34:1; [M-H]-@5.92
PG 34:1
ME219900
-
-
5.92
-
PG 36:0; [M-H]-@6.92
PG 36:0
ME219901
-
-
6.92
-
PG 36:2; [M-H]-@5.97
PG 36:2
ME219902
-
-
5.97
-
PI 32:1; [M-H]-@5.07
PI 32:1
ME219903
-
-
5.07
-
PI 34:1; [M-H]-@5.74
PI 34:1
ME219904
-
-
5.74
-
PI 34:2; [M-H]-@5.28
PI 34:2
ME219905
-
-
5.28
-
PI 35:1; [M-H]-@6.00
PI 35:1
ME219906
-
-
6
-
PI 36:2; [M-H]-@5.94
PI 36:2
ME219907
-
-
5.94
-
PI 36:3; [M-H]-@5.45
PI 36:3
ME219908
-
-
5.45
-
PI 36:4; [M-H]-@5.28
PI 36:4
ME219909
-
-
5.28
-
PI 38:3; [M-H]-@6.16
PI 38:3
ME219910
-
-
6.16
-
PI 38:4; [M-H]-@5.89
PI 38:4
ME219911
-
-
5.89
-
PI 38:5; [M-H]-@5.38
PI 38:5
ME219912
-
-
5.38
-
PI 40:5; [M-H]-@5.98
PI 40:5
ME219913
-
-
5.98
-
PI 40:6; [M-H]-@5.84
PI 40:6
ME219914
-
-
5.84
-
plasmenyl-PE 32:0; [M-H]-@7.02
PE P-32:0
ME219930
-
-
7.02
-
plasmenyl-PE 32:1; [M-H]-@6.52
PE P-32:1
ME219931
-
-
6.52
-
plasmenyl-PE 33:1; [M-H]-@6.81
PE P-33:1
ME219932
-
-
6.81
-
plasmenyl-PE 34:0; [M-H]-@7.27
PE P-34:0
ME219933
-
-
7.27
-
plasmenyl-PE 34:1; [M-H]-@7.10
PE P-34:1
ME219934
-
-
7.1
-
plasmenyl-PE 34:2; [M-H]-@6.65
PE P-34:2
ME219935
-
-
6.65
-
plasmenyl-PE 34:3; [M-H]-@6.29
PE P-34:3
ME219936
-
-
6.29
-
plasmenyl-PE 36:1; [M-H]-@7.66
PE P-36:1
ME219937
-
-
7.66
-
plasmenyl-PE 36:2; [M-H]-@7.24
PE P-36:2
ME219938
-
-
7.24
-
plasmenyl-PE 36:3; [M-H]-@6.82
PE P-36:3
ME219939
-
-
6.82
-
plasmenyl-PE 36:4; [M-H]-@6.58
PE P-36:4
ME219940
-
-
6.58
-
plasmenyl-PE 36:5; [M-H]-@6.24
PE P-36:5
ME219941
-
-
6.24
-
plasmenyl-PE 38:1; [M-H]-@8.16
PE P-38:1
ME219942
-
-
8.16
-
plasmenyl-PE 38:2; [M-H]-@7.79
PE P-38:2
ME219943
-
-
7.79
-
plasmenyl-PE 38:3; [M-H]-@7.41
PE P-38:3
ME219944
-
-
7.41
-
plasmenyl-PE 38:4; [M-H]-@7.29
PE P-38:4
ME219945
-
-
7.29
-
plasmenyl-PE 38:5; [M-H]-@6.68
PE P-38:5
ME219946
-
-
6.68
-
plasmenyl-PE 38:6; [M-H]-@6.49
PE P-38:6
ME219947
-
-
6.49
-
plasmenyl-PE 40:3; [M-H]-@8.02
PE P-40:3
ME219948
-
-
8.02
-
plasmenyl-PE 40:4; [M-H]-@7.71
PE P-40:4
ME219949
-
-
7.71
-
plasmenyl-PE 40:5; [M-H]-@7.34
PE P-40:5
ME219950
-
-
7.34
-
plasmenyl-PE 40:6; [M-H]-@7.09
PE P-40:6
ME219951
-
-
7.09
-
plasmenyl-PE 42:5; [M-H]-@7.82
PE P-42:5
ME219952
-
-
7.82
-
plasmenyl-PE 42:6; [M-H]-@7.70
PE P-42:6
ME219953
-
-
7.7
-
PS 36:1; [M-H]-@6.52
PS 36:1
ME219915
-
-
6.52
-
PS 38:4; [M-H]-@6.06
PS 38:4
ME219916
-
-
6.06
-
Unknown_742.54(-)@5.61
-
ME219917
-
-
-
-
Unknown_742.54(-)@6.25
-
ME219918
-
-
-
-
Analysis: C18 POSITIVE ION MODE/Triple TOF
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
CE(16:0); [M+NH4]+@10.93
CE 16:0
ME219954
246520
-
10.93
-
CE(16:1); [M+NH4]+@10.63
CE 16:1
ME219955
-
-
10.63
-
CE(17:1); [M+NH4]+@10.82
CE 17:1
ME219956
24779603
-
10.82
-
CE(18:1); [M+NH4]+@10.88
CE 18:1
ME219957
5283632
-
10.88
-
CE(18:2); [M+NH4]+@10.70
CE 18:2
ME219958
5287939
-
10.7
-
CE(18:3); [M+NH4]+@10.46
CE 18:3
ME219959
6436907
-
10.46
-
CE(20:1); [M+NH4]+@11.23
CE 20:1
ME219960
16061337
-
11.23
-
CE(20:2); [M+NH4]+@11.03
CE 20:2
ME219961
16061338
-
11.03
-
CE(20:3); [M+NH4]+@10.73
CE 20:3
ME219962
14274976
-
10.73
-
CE(20:4); [M+NH4]+@10.51
CE 20:4
ME219963
6479222
-
10.51
-
CE(20:5); [M+NH4]+@10.35
CE 20:5
ME219964
10372299
-
10.35
-
CE(22:4); [M+NH4]+@10.83
CE 22:4
ME219965
16061341
-
10.83
-
CE(22:5); [M+NH4]+@10.66
CE 22:5
ME219966
42608400
-
10.66
-
CE(22:6); [M+NH4]+@10.44
CE 22:6
ME219967
14274978
-
10.44
-
DG 26:1; [M+NH4]+@5.51
DG 26:1
ME219968
-
-
5.51
-
DG 30:0; [M+NH4]+@7.35
DG 30:0
ME219969
-
-
7.35
-
DG 32:0; [M+NH4]+@7.86
DG 32:0
ME219970
-
-
7.86
-
DG 32:1; [M+NH4]+@7.43
DG 32:1
ME219971
-
-
7.43
-
DG 32:2; [M+NH4]+@6.99
DG 32:2
ME219972
-
-
6.99
-
DG 33:1; [M+NH4]+@7.70
DG 33:1
ME219973
-
-
7.7
-
DG 34:0; [M+NH4]+@8.36
DG 34:0
ME219974
-
-
8.36
-
DG 34:2; [M+NH4]+@7.52
DG 34:2
ME219975
-
-
7.52
-
DG 34:3; [M+NH4]+@7.16
DG 34:3
ME219976
-
-
7.16
-
DG 34:4; [M+NH4]+@6.83
DG 34:4
ME219977
-
-
6.83
-
DG 35:1; [M+NH4]+@8.16
DG 35:1
ME219978
-
-
8.16
-
DG 35:2; [M+NH4]+@7.81
DG 35:2
ME219979
-
-
7.81
-
DG 36:0; [M+NH4]+@8.68
DG 36:0
ME219980
-
-
8.68
-
DG 36:1; [M+NH4]+@8.41
DG 36:1
ME219981
-
-
8.41
-
DG 36:2; [M+NH4]+@8.00
DG 36:2
ME219982
-
-
8
-
DG 36:3; [M+NH4]+@7.67
DG 36:3
ME219983
-
-
7.67
-
DG 36:4; [M+NH4]+@7.34
DG 36:4
ME219984
-
-
7.34
-
DG 36:5; [M+NH4]+@6.97
DG 36:5
ME219985
-
-
6.97
-
DG 38:1; [M+NH4]+@8.64
DG 38:1
ME219986
-
-
8.64
-
DG 38:2; [M+NH4]+@8.47
DG 38:2
ME219987
-
-
8.47
-
DG 38:3; [M+NH4]+@8.17
DG 38:3
ME219988
-
-
8.17
-
DG 38:4; [M+NH4]+@8.01
DG 38:4
ME219989
-
-
8.01
-
DG 38:5; [M+NH4]+@7.55
DG 38:5
ME219990
-
-
7.55
-
DG 38:6; [M+NH4]+@7.24
DG 38:6
ME219991
-
-
7.24
-
DG 38:7; [M+NH4]+@6.87
DG 38:7
ME219992
-
-
6.87
-
DG 40:3; [M+NH4]+@8.57
DG 40:3
ME219993
-
-
8.57
-
DG 40:6; [M+NH4]+@7.74
DG 40:6
ME219994
-
-
7.74
-
DG 40:7; [M+NH4]+@7.46
DG 40:7
ME219995
-
-
7.46
-
lysoPC 14:0; [M+H]+@1.04
LPC 14:0
ME220188
-
-
1.04
-
lysoPC 15:0; [M+H]+@1.20
LPC 15:0
ME220189
24779458
-
1.2
-
lysoPC 16:0; [M+H]+@1.54
LPC 16:0
ME220190
-
-
1.54
-
lysoPC 16:1; [M+H]+@1.22
LPC 16:1
ME220191
-
-
1.22
-
lysoPC 17:1; [M+H]+@1.41
LPC 17:1
ME220192
-
-
1.41
-
lysoPC 18:0; [M+H]+@2.31
LPC 18:0
ME220193
-
-
2.31
-
lysoPC 18:1; [M+H]+@1.71
LPC 18:1
ME220194
-
-
1.71
-
lysoPC 18:2; [M+H]+@1.30
LPC 18:2
ME220195
-
-
1.3
-
lysoPC 18:3; [M+H]+@1.07
LPC 18:3
ME220196
-
-
1.07
-
lysoPC 19:0; [M+H]+@2.79
LPC 19:0
ME220197
24779472
-
2.79
-
lysoPC 20:0; [M+H]+@3.25
LPC 20:0
ME220198
24779473
-
3.25
-
lysoPC 20:1; [M+H]+@2.48
LPC 20:1
ME220199
-
-
2.48
-
lysoPC 20:2; [M+H]+@1.89
LPC 20:2
ME220200
52924053
-
1.89
-
lysoPC 20:3; [M+H]+@1.49
LPC 20:3
ME220201
-
-
1.49
-
lysoPC 20:4; [M+H]+@1.34
LPC 20:4
ME220202
-
-
1.34
-
lysoPC 20:5; [M+H]+@0.99
LPC 20:5
ME220203
11757087
-
0.99
-
lysoPC 22:0; [M+H]+@4.17
LPC 22:0
ME220204
24779479
-
4.17
-
lysoPC 22:1; [M+H]+@3.36
LPC 22:1
ME220205
-
-
3.36
-
lysoPC 22:4; [M+H]+@1.74
LPC 22:4
ME220206
52924039
-
1.74
-
lysoPC 22:5; [M+H]+@1.45
LPC 22:5
ME220207
-
-
1.45
-
lysoPC 22:6; [M+H]+@1.27
LPC 22:6
ME220208
10415542
-
1.27
-
lysoPC 24:0; [M+H]+@5.06
LPC 24:0
ME220209
24779481
-
5.06
-
lysoPC 24:1; [M+H]+@4.20
LPC 24:1
ME220210
53480477
-
4.2
-
lysoPE 16:1; [M+H]+@1.18
LPE 16:1
ME220211
-
-
1.18
-
MG 17:0; [M+Li]+@3.12
MG 17:0
ME219996
107036
-
3.12
-
PC 19:1; [M+H]+@1.76
PC 19:1
ME219997
24778752
-
1.76
-
PC 21:4; [M+Na]+@1.26
PC 21:4
ME219998
-
-
1.26
-
PC 26:0; [M+H]+@4.42
PC 26:0
ME219999
-
-
4.42
-
PC 28:0; [M+H]+@5.17
PC 28:0
ME220000
-
-
5.17
-
PC 29:0; [M+H]+@5.50
PC 29:0
ME220001
-
-
5.5
-
PC 30:0; [M+H]+@5.78
PC 30:0
ME220002
-
-
5.78
-
PC 30:3; [M+H]+@5.13
PC 30:3
ME220003
-
-
5.13
-
PC 31:1; [M+Na]+@5.66
PC 31:1
ME220004
-
-
5.66
-
PC 32:0; [M+H]+@6.45
PC 32:0
ME220005
-
-
6.45
-
PC 32:1; [M+H]+@5.93
PC 32:1
ME220006
-
-
5.93
-
PC 32:2; [M+H]+@6.54
PC 32:2
ME220007
-
-
6.54
-
PC 32:3; [M+H]+@5.11
PC 32:3
ME220008
-
-
5.11
-
PC 32:4; [M+H]+@5.35
PC 32:4
ME220009
-
-
5.35
-
PC 33:3; [M+H]+@5.47
PC 33:3
ME220010
-
-
5.47
-
PC 34:1; [M+H]+@6.54
PC 34:1
ME220011
-
-
6.54
-
PC 34:2; [M+H]+@6.12
PC 34:2
ME220012
-
-
6.12
-
PC 34:3; [M+H]+@5.61
PC 34:3
ME220013
-
-
5.61
-
PC 35:2; [M+H]+@6.48
PC 35:2
ME220014
-
-
6.48
-
PC 35:3; [M+H]+@6.31
PC 35:3
ME220015
-
-
6.31
-
PC 35:4; [M+H]+@5.58
PC 35:4
ME220016
-
-
5.58
-
PC 35:5; [M+H]+@5.43
PC 35:5
ME220017
-
-
5.43
-
PC 36:0; [M+H]+@7.63
PC 36:0
ME220018
-
-
7.63
-
PC 36:1; [M+H]+@7.16
PC 36:1
ME220019
-
-
7.16
-
PC 36:3; [M+H]+@6.29
PC 36:3
ME220020
-
-
6.29
-
PC 36:4; [M+H]+@6.00
PC 36:4
ME220021
-
-
6
-
PC 36:5; [M+H]+@5.71
PC 36:5
ME220022
-
-
5.71
-
PC 36:6; [M+H]+@5.43
PC 36:6
ME220023
-
-
5.43
-
PC 36:7; [M+H]+@5.28
PC 36:7
ME220024
-
-
5.28
-
PC 37:6; [M+H]+@5.63
PC 37:6
ME220025
-
-
5.63
-
PC 38:2; [M+H]+@7.32
PC 38:2
ME220026
-
-
7.32
-
PC 38:3; [M+H]+@6.95
PC 38:3
ME220027
-
-
6.95
-
PC 38:4; [M+H]+@6.73
PC 38:4
ME220028
-
-
6.73
-
PC 38:5; [M+H]+@6.23
PC 38:5
ME220029
-
-
6.23
-
PC 38:6; [M+H]+@6.03
PC 38:6
ME220030
-
-
6.03
-
PC 38:7; [M+H]+@5.50
PC 38:7
ME220031
-
-
5.5
-
PC 38:8; [M+H]+@5.31
PC 38:8
ME220032
-
-
5.31
-
PC 38:9; [M+H]+@5.39
PC 38:9
ME220033
-
-
5.39
-
PC 39:7; [M+H]+@6.12
PC 39:7
ME220034
-
-
6.12
-
PC 40:10; [M+H]+@5.44
PC 40:10
ME220035
-
-
5.44
-
PC 40:2; [M+H]+@7.83
PC 40:2
ME220036
-
-
7.83
-
PC 40:3; [M+H]+@7.59
PC 40:3
ME220037
-
-
7.59
-
PC 40:4; [M+H]+@7.58
PC 40:4
ME220038
-
-
7.58
-
PC 40:6; [M+H]+@6.66
PC 40:6
ME220039
-
-
6.66
-
PC 40:7; [M+H]+@6.79
PC 40:7
ME220040
-
-
6.79
-
PC 40:8; [M+H]+@6.30
PC 40:8
ME220041
-
-
6.3
-
PC 40:9; [M+H]+@5.98
PC 40:9
ME220042
-
-
5.98
-
PC 41:5; [M+H]+@7.05
PC 41:5
ME220043
-
-
7.05
-
PC 41:6; [M+H]+@7.01
PC 41:6
ME220044
-
-
7.01
-
PC 42:4; [M+H]+@7.89
PC 42:4
ME220045
-
-
7.89
-
PC 42:5; [M+H]+@7.62
PC 42:5
ME220046
-
-
7.62
-
PC 42:7; [M+H]+@6.76
PC 42:7
ME220047
-
-
6.76
-
PC 42:8; [M+H]+@6.31
PC 42:8
ME220048
-
-
6.31
-
PC 42:9; [M+H]+@5.72
PC 42:9
ME220049
-
-
5.72
-
PC 44:5; [M+H]+@7.89
PC 44:5
ME220050
-
-
7.89
-
PE 36:0; [M+H]+@7.75
PE 36:0
ME220051
-
-
7.75
-
plasmenyl-PC 18:0; [M+Na]+@1.75
PC P-18:0
ME220212
-
-
1.75
-
plasmenyl-PE 42:4; [M+H]+@8.10
PE P-42:4
ME220213
-
-
8.1
-
SM 21:0; [M]+@1.61
SM 18:1;O2/21:0
ME220052
-
-
1.61
-
SM 30:1; [M]+@4.30
SM 30:1;O2
ME220053
-
-
4.3
-
SM 31:1; [M]+@4.71
SM 31:1;O2
ME220054
-
-
4.71
-
SM 32:0; [M]+@5.36
SM 32:0;O2
ME220055
44260138
-
5.36
-
SM 32:1; [M]+@5.08
SM 32:1;O2
ME220056
11433862
-
5.08
-
SM 32:2; [M]+@4.57
SM 32:2;O2
ME220057
-
-
4.57
-
SM 33:0; [M]+@5.70
SM 33:0;O2
ME220058
-
-
5.7
-
SM 33:1; [M]+@5.26
SM 33:1;O2
ME220059
52931139
-
5.26
-
SM 33:2; [M]+@4.88
SM 33:2;O2
ME220060
-
-
4.88
-
SM 34:1; [M]+@5.76
SM 34:1;O2
ME220061
-
-
5.76
-
SM 34:2; [M]+@5.17
SM 34:2;O2
ME220062
-
-
5.17
-
SM 35:0; [M]+@6.38
SM 35:0;O2
ME220063
-
-
6.38
-
SM 35:2; [M]+@5.45
SM 35:2;O2
ME220064
-
-
5.45
-
SM 36:1; [M]+@6.41
SM 36:1;O2
ME220065
44260139
-
6.41
-
SM 36:2; [M]+@5.91
SM 36:2;O2
ME220066
-
-
5.91
-
SM 37:1; [M]+@6.80
SM 37:1;O2
ME220067
-
-
6.8
-
SM 37:2; [M]+@6.31
SM 37:2;O2
ME220068
-
-
6.31
-
SM 38:1; [M]+@6.99
SM 38:1;O2
ME220069
-
-
6.99
-
SM 39:0; [M]+@7.60
SM 39:0;O2
ME220070
-
-
7.6
-
SM 39:1; [M]+@7.33
SM 39:1;O2
ME220071
-
-
7.33
-
SM 39:2; [M]+@6.91
SM 39:2;O2
ME220072
-
-
6.91
-
SM 40:0; [M]+@7.85
SM 40:0;O2
ME220073
44260132
-
7.85
-
SM 40:1; [M]+@7.59
SM 40:1;O2
ME220074
-
-
7.59
-
SM 40:2; [M]+@7.14
SM 40:2;O2
ME220075
-
-
7.14
-
SM 40:4; [M]+@6.24
SM 40:4;O2
ME220076
-
-
6.24
-
SM 41:1; [M]+@7.60
SM 41:1;O2
ME220077
-
-
7.6
-
SM 41:2; [M+Na]+@7.45
SM 41:2;O2
ME220078
-
-
7.45
-
SM 42:1; [M]+@8.10
SM 42:1;O2
ME220079
44260133
-
8.1
-
SM 42:2; [M]+@7.61
SM 42:2;O2
ME220080
-
-
7.61
-
SM 42:4; [M]+@6.83
SM 42:4;O2
ME220081
-
-
6.83
-
SM 42:5; [M]+@6.45
SM 42:5;O2
ME220082
-
-
6.45
-
SM 43:1; [M+Na]+@8.32
SM 43:1;O2
ME220083
-
-
8.32
-
SM 43:2; [M]+@8.08
SM 43:2;O2
ME220084
-
-
8.08
-
SM 44:1; [M]+@8.61
SM 44:1;O2
ME220085
-
-
8.61
-
TG 40:0; [M+NH4]+@9.47
TG 40:0
ME220086
-
-
9.47
-
TG 40:1; [M+NH4]+@9.14
TG 40:1
ME220087
-
-
9.14
-
TG 42:0; [M+NH4]+@9.75
TG 42:0
ME220088
-
-
9.75
-
TG 42:1; [M+NH4]+@9.50
TG 42:1
ME220089
-
-
9.5
-
TG 42:2; [M+NH4]+@9.21
TG 42:2
ME220090
-
-
9.21
-
TG 44:1; [M+NH4]+@9.78
TG 44:1
ME220091
-
-
9.78
-
TG 44:2; [M+NH4]+@9.52
TG 44:2
ME220092
-
-
9.52
-
TG 46:0; [M+NH4]+@10.30
TG 46:0
ME220093
-
-
10.3
-
TG 46:1; [M+NH4]+@10.07
TG 46:1
ME220094
-
-
10.07
-
TG 46:2; [M+NH4]+@9.81
TG 46:2
ME220095
-
-
9.81
-
TG 46:3; [M+NH4]+@9.60
TG 46:3
ME220096
-
-
9.6
-
TG 48:0; [M+NH4]+@10.54
TG 48:0
ME220097
-
-
10.54
-
TG 48:1; [M+NH4]+@10.32
TG 48:1
ME220098
-
-
10.32
-
TG 48:2; [M+NH4]+@10.10
TG 48:2
ME220099
-
-
10.1
-
TG 48:3; [M+NH4]+@9.86
TG 48:3
ME220100
-
-
9.86
-
TG 49:0; [M+NH4]+@10.66
TG 49:0
ME220101
-
-
10.66
-
TG 49:1; [M+NH4]+@10.46
TG 49:1
ME220102
-
-
10.46
-
TG 49:2; [M+NH4]+@10.24
TG 49:2
ME220103
-
-
10.24
-
TG 49:3; [M+NH4]+@10.03
TG 49:3
ME220104
-
-
10.03
-
TG 50:0; [M+NH4]+@10.78
TG 50:0
ME220105
-
-
10.78
-
TG 50:1; [M+NH4]+@10.54
TG 50:1
ME220106
-
-
10.54
-
TG 50:2; [M+NH4]+@10.33
TG 50:2
ME220107
-
-
10.33
-
TG 50:3; [M+NH4]+@10.13
TG 50:3
ME220108
-
-
10.13
-
TG 50:4; [M+NH4]+@9.91
TG 50:4
ME220109
-
-
9.91
-
TG 50:5; [M+NH4]+@9.73
TG 50:5
ME220110
-
-
9.73
-
TG 51:1; [M+NH4]+@10.69
TG 51:1
ME220111
-
-
10.69
-
TG 51:2; [M+NH4]+@10.50
TG 51:2
ME220112
-
-
10.5
-
TG 51:3; [M+NH4]+@10.30
TG 51:3
ME220113
-
-
10.3
-
TG 51:4; [M+NH4]+@10.10
TG 51:4
ME220114
-
-
10.1
-
TG 51:5; [M+NH4]+@9.88
TG 51:5
ME220115
-
-
9.88
-
TG 51:6; [M+NH4]+@9.64
TG 51:6
ME220116
-
-
9.64
-
TG 52:0; [M+NH4]+@11.03
TG 52:0
ME220117
-
-
11.03
-
TG 52:1; [M+NH4]+@10.81
TG 52:1
ME220118
-
-
10.81
-
TG 52:2; [M+NH4]+@10.58
TG 52:2
ME220119
-
-
10.58
-
TG 52:3; [M+NH4]+@10.38
TG 52:3
ME220120
-
-
10.38
-
TG 52:4; [M+NH4]+@10.18
TG 52:4
ME220121
-
-
10.18
-
TG 52:5; [M+NH4]+@9.99
TG 52:5
ME220122
-
-
9.99
-
TG 52:6; [M+NH4]+@9.82
TG 52:6
ME220123
-
-
9.82
-
TG 52:7; [M+NH4]+@9.66
TG 52:7
ME220124
-
-
9.66
-
TG 53:1; [M+NH4]+@10.92
TG 53:1
ME220125
-
-
10.92
-
TG 53:2; [M+NH4]+@10.73
TG 53:2
ME220126
-
-
10.73
-
TG 53:3; [M+NH4]+@10.52
TG 53:3
ME220127
-
-
10.52
-
TG 53:4; [M+NH4]+@10.34
TG 53:4
ME220128
-
-
10.34
-
TG 53:5; [M+NH4]+@10.16
TG 53:5
ME220129
-
-
10.16
-
TG 53:6; [M+NH4]+@10.03
TG 53:6
ME220130
-
-
10.03
-
TG 53:7; [M+NH4]+@9.76
TG 53:7
ME220131
-
-
9.76
-
TG 54:0; [M+NH4]+@11.24
TG 54:0
ME220132
-
-
11.24
-
TG 54:1; [M+NH4]+@11.04
TG 54:1
ME220133
-
-
11.04
-
TG 54:2; [M+NH4]+@10.84
TG 54:2
ME220134
-
-
10.84
-
TG 54:3; [M+NH4]+@10.66
TG 54:3
ME220135
-
-
10.66
-
TG 54:4; [M+NH4]+@10.45
TG 54:4
ME220136
-
-
10.45
-
TG 54:5; [M+NH4]+@10.23
TG 54:5
ME220137
-
-
10.23
-
TG 54:6; [M+NH4]+@10.04
TG 54:6
ME220138
-
-
10.04
-
TG 54:7; [M+NH4]+@9.88
TG 54:7
ME220139
-
-
9.88
-
TG 54:8; [M+NH4]+@9.72
TG 54:8
ME220140
-
-
9.72
-
TG 54:9; [M+NH4]+@9.56
TG 54:9
ME220141
-
-
9.56
-
TG 55:2; [M+NH4]+@10.95
TG 55:2
ME220142
-
-
10.95
-
TG 55:3; [M+NH4]+@10.76
TG 55:3
ME220143
-
-
10.76
-
TG 55:4; [M+NH4]+@10.56
TG 55:4
ME220144
-
-
10.56
-
TG 55:5; [M+NH4]+@10.47
TG 55:5
ME220145
-
-
10.47
-
TG 55:6; [M+NH4]+@10.28
TG 55:6
ME220146
-
-
10.28
-
TG 55:7; [M+NH4]+@10.10
TG 55:7
ME220147
-
-
10.1
-
TG 55:8; [M+NH4]+@9.93
TG 55:8
ME220148
-
-
9.93
-
TG 56:10; [M+NH4]+@9.66
TG 56:10
ME220150
-
-
9.66
-
TG 56:1; [M+NH4]+@11.24
TG 56:1
ME220149
-
-
11.24
-
TG 56:2; [M+NH4]+@11.05
TG 56:2
ME220151
-
-
11.05
-
TG 56:3; [M+NH4]+@10.88
TG 56:3
ME220152
-
-
10.88
-
TG 56:4; [M+NH4]+@10.71
TG 56:4
ME220153
-
-
10.71
-
TG 56:5; [M+NH4]+@10.55
TG 56:5
ME220154
-
-
10.55
-
TG 56:6; [M+NH4]+@10.39
TG 56:6
ME220155
-
-
10.39
-
TG 56:7; [M+NH4]+@10.19
TG 56:7
ME220156
-
-
10.19
-
TG 56:8; [M+NH4]+@10.00
TG 56:8
ME220157
-
-
10
-
TG 56:9; [M+NH4]+@9.81
TG 56:9
ME220158
-
-
9.81
-
TG 57:1; [M+NH4]+@11.40
TG 57:1
ME220159
-
-
11.4
-
TG 57:2; [M+NH4]+@11.18
TG 57:2
ME220160
-
-
11.18
-
TG 57:9; [M+NH4]+@10.02
TG 57:9
ME220161
-
-
10.02
-
TG 58:10; [M+NH4]+@9.94
TG 58:10
ME220163
-
-
9.94
-
TG 58:11; [M+NH4]+@9.77
TG 58:11
ME220164
-
-
9.77
-
TG 58:1; [M+NH4]+@11.54
TG 58:1
ME220162
-
-
11.54
-
TG 58:2; [M+NH4]+@11.30
TG 58:2
ME220165
-
-
11.3
-
TG 58:3; [M+NH4]+@11.09
TG 58:3
ME220166
-
-
11.09
-
TG 58:4; [M+NH4]+@10.93
TG 58:4
ME220167
-
-
10.93
-
TG 58:5; [M+NH4]+@10.78
TG 58:5
ME220168
-
-
10.78
-
TG 58:6; [M+NH4]+@10.59
TG 58:6
ME220169
-
-
10.59
-
TG 58:7; [M+NH4]+@10.43
TG 58:7
ME220170
-
-
10.43
-
TG 58:8; [M+NH4]+@10.30
TG 58:8
ME220171
-
-
10.3
-
TG 58:9; [M+NH4]+@10.14
TG 58:9
ME220172
-
-
10.14
-
TG 60:10; [M+NH4]+@10.18
TG 60:10
ME220173
-
-
10.18
-
TG 60:11; [M+NH4]+@10.05
TG 60:11
ME220174
-
-
10.05
-
TG 60:12; [M+NH4]+@9.90
TG 60:12
ME220175
-
-
9.9
-
TG 60:13; [M+NH4]+@9.72
TG 60:13
ME220176
-
-
9.72
-
TG 60:3; [M+NH4]+@11.29
TG 60:3
ME220177
-
-
11.29
-
TG 60:4; [M+NH4]+@11.12
TG 60:4
ME220178
-
-
11.12
-
TG 60:6; [M+NH4]+@10.81
TG 60:6
ME220179
-
-
10.81
-
TG 60:7; [M+NH4]+@10.68
TG 60:7
ME220180
-
-
10.68
-
TG 60:8; [M+NH4]+@10.52
TG 60:8
ME220181
-
-
10.52
-
TG 60:9; [M+NH4]+@10.35
TG 60:9
ME220182
-
-
10.35
-
TG 62:13; [M+NH4]+@9.93
TG 62:13
ME220183
-
-
9.93
-
TG 62:14; [M+NH4]+@9.84
TG 62:14
ME220184
-
-
9.84
-
TG 62:3; [M+NH4]+@11.55
TG 62:3
ME220185
-
-
11.55
-
TG 62:4; [M+NH4]+@11.33
TG 62:4
ME220186
-
-
11.33
-
TG 62:5; [M+NH4]+@11.15
TG 62:5
ME220187
-
-
11.15
-
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