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Return to study ST000842 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
OXALOACETIC ACID (M-H)-[-H2O]
Oxaloacetic acid
ME223339
970
-
0.566
132.0034
CARNOSINE (M-H)-
Carnosine
ME223342
439224
-
0.629
226.1065
GLUCOSE (M+Cl)-
Glucose
ME223317
5793
-
0.691
180.0643
CREATINE (M-H)-
Creatine
ME223354
586
-
0.701
131.069
2-DEOXY-D-GLUCOSE (M+Cl)-
2-Deoxy-glucose
ME223332
439268
-
0.736
164.0686
PYRUVIC ACID (M-H)-
Pyruvic acid
ME223335
1060
-
0.742
88.0163
ISOCITRIC ACID (M-H)-
Isocitric acid
ME223337
5318532
-
0.748
192.0269
GLYCERIC ACID (M-H)-
Glyceric acid
ME223299
439194
-
0.75
106.0266
MALIC ACID (M-H)+[-H2O]
Malic acid
ME223352
222656
-
0.75
134.0229
MALIC ACID (M-H)-
Malic acid
ME223314
222656
-
0.751
134.0217
GLUCONIC ACID (M-H)-
Gluconic acid
ME223340
10690
-
0.765
196.0571
DEHYDROASCORBIC ACID (M-H)-
L-Dehydroascorbic acid
ME223286
440667
-
0.787
174.0161
PHOSPHOCREATINE (M-H)-
Phosphocreatine
ME223355
9548602
-
0.835
211.036
ALPHA-KETO-GLUTARIC ACID (M-H)-
2-Oxoglutaric acid
ME223343
51
-
0.91
146.0215
INOSINE 5'-PHOSPHATE (M-H)-
IMP
ME223278
8582
-
0.987
348.0475
CITRIC ACID (M-H)-
Citric acid
ME223288
311
-
1.018
192.0269
3-DEHYDROSHIKIMIC ACID (M-H)-
3-Dehydroshikimate
ME223350
439774
-
1.022
172.0355
NAD (M-H)-
NAD+
ME223351
5893
-
1.034
663.1092
URIC ACID (M-H)-
Uric acid
ME223313
1175
-
1.041
168.0274
AZELAIC ACID (M-H)-
Azelaic acid
ME223302
2266
-
10.635
188.1046
MALEIC ACID (M-H)-
Maleic acid
ME223349
444266
-
1.098
116.0111
TRANS-ACONITIC ACID (M-H)-
trans-Aconitic acid
ME223292
444212
-
1.125
174.0166
5-OXOPROLINE (M-H)-
Pyroglutamic acid
ME223287
7405
-
1.164
129.0424
FUMARIC ACID (2M-H)-
Fumaric acid
ME223348
444972
-
1.25
116.0108
FUMARIC ACID (M-H)-
Fumaric acid
ME223353
444972
-
1.25
116.0111
IBUPROFEN CARBOXYLIC ACID (M-H)-
-
ME223322
10444113
-
12.927
236.1064
SUCCINIC ACID (M-H)-
Succinic acid
ME223289
1110
-
1.302
118.0266
CORTISONE (M+Cl)-
Cortisone
ME223279
222786
-
13.305
360.1921
2-OXOADIPIC ACID (M-H)-
Oxoadipic acid
ME223344
71
-
1.332
160.0368
TRICARBALLYLIC ACID (M-H)-[-H2O]
1,2,3-Propanetricarboxylic acid
ME223319
14925
-
1.349
176.0319
TYROSINE (M-H)-
Tyrosine
ME223271
6057
-
1.357
181.0718
GLUTATHIONE (OXIDIZED) (M-H)-
Glutathione
ME223347
65359
-
1.361
612.1519
URIDINE (M+Cl)-
Uridine
ME223324
6029
-
1.37
244.0697
URIDINE (M-H)-
Uridine
ME223290
6029
-
1.37
244.0692
CORTISOL (M+Cl)-
Cortisol
ME223328
5754
-
13.721
362.2083
CORTISOL (M+HCOO)-
Cortisol
ME223329
5754
-
13.722
362.2086
CITRAMALIC ACID (M-H)-
Citramalic acid
ME223269
441696
-
1.383
148.0366
METHYLMALONIC ACID (M-H)-
Methylmalonic acid
ME223309
487
-
1.489
118.0267
N-ACETYL-L-ALANINE (M-H)-
N-Acetylalanine
ME223306
88064
-
1.493
131.0588
CORTICOSTERONE (M+Cl)-
Corticosterone
ME223304
5753
-
15.328
346.2104
2,4-DIHYDROXYPTERIDINE (M-H)-
Lumazine
ME223358
10250
-
1.55
164.032
3-HYDROXY-3-METHYLGLUTARIC ACID (M-H)-
3-Hydroxymethylglutaric acid
ME223336
1662
-
1.58
162.0516
THYMINE-D4(METHYL-D3,6-D1) [ISTD] (M-H)-
-
ME223357
16213347
-
1.681
130.0678
DEOXYURIDINE (M+Cl)-
Deoxyuridine
ME223346
13712
-
1.686
228.0723
ALPHA-HYDROXYISOBUTYRIC ACID (M-H)-
2-Hydroxyisobutyric acid
ME223325
11671
-
1.713
104.0474
INOSINE (M+Cl)-
Inosine
ME223297
6021
-
1.82
268.0808
INOSINE (M-H)-
Inosine
ME223298
6021
-
1.82
268.0808
4-PYRIDOXIC ACID (M-H)-
4-Pyridoxic acid
ME223283
6723
-
1.832
183.053
BILIVERDIN (M-H)-
Biliverdin
ME223276
5280353
-
18.594
582.253
IBUPROFEN (M-H)-
Ibuprofen
ME223333
114864
-
18.812
206.1304
EPIBRASSINOLIDE [ISTD] (M+HCOO)-
24-epi-Brassinolide
ME223310
3239
-
19.759
480.3463
CHOLIC ACID (M-H)-
Cholic acid
ME223331
221493
-
20.259
408.2847
URSODIOL (M+HCOO)-
Ursodeoxycholic acid
ME223323
31401
-
21.566
392.2918
LAURIC ACID (M-H)-
Lauric acid
ME223305
3893
-
21.741
200.1771
MYRISTOLEIC ACID (M-H)-
Myristoleic acid
ME223326
5281119
-
22.075
226.1932
16:0 LYSO PC (M+HCOO)-
LPC 16:0
ME223296
460602
-
22.251
495.3323
RETINOIC ACID (M-H)-
Retinoic acid
ME223308
444795
-
22.269
300.2105
MYRISTIC ACID (M-H)-
Myristic acid
ME223270
11005
-
22.453
228.2088
PALMITOLEIC ACID (M-H)-
Palmitoleic acid
ME223315
445638
-
22.591
254.2246
OLEOYL-GLYCEROL (M+HCOO)-
MG 18:1
ME223318
5319879
-
22.658
356.2926
18:0 LYSO-PE (M-H)-
LPE 18:0
ME223266
9547068
-
22.687
481.3176
DOCOSAHEXAENOIC ACID (M-H)-
Docosahexaenoic acid
ME223295
445580
-
22.696
328.2404
ARACHIDONIC ACID (M-H)-
Arachidonic acid
ME223259
444899
-
22.709
304.2405
LINOLEIC ACID (M-H)-
Linoleic acid
ME223321
5280450
-
22.723
280.2407
ALPHA-LINOLENIC ACID (M+HCOO)-
alpha-Linolenic acid
ME223301
5280934
-
22.852
278.2222
PALMITIC ACID (M-H)-
Palmitic acid
ME223307
985
-
22.852
256.2406
HYODEOXYCHOLIC ACID (M-H)-
Hyodeoxycholic acid
ME223282
5283820
-
22.9
392.2958
TRANS-VACCENIC ACID (M-H)-
trans-Vaccenic acid
ME223300
5281127
-
22.93
282.2565
HEPTADECANOIC ACID (M-H)-
Margaric acid
ME223277
10465
-
23.011
270.2556
STEARIC ACID (M-H)-
Stearic acid
ME223275
5281
-
23.18
284.272
CIS-11-EICOSENOIC ACID (M-H)-
cis-Gondoic acid
ME223265
5282768
-
23.252
310.287
CIS-7,10,13,16-DOCOSATETRAENOIC ACID (M+HCOO)-
Adrenic acid
ME223356
5497181
-
23.254
332.2735
PHYTANIC ACID (M-H)-
Phytanic acid
ME223261
10380830
-
23.257
312.3019
ARACHIDIC ACID (M-H)-
Arachidic acid
ME223291
10467
-
23.575
312.3028
ERUCIC ACID (M-H)-
cis-Erucic acid
ME223268
5281116
-
23.646
338.3185
BEHENIC ACID (M-H)-
Behenic acid
ME223330
8215
-
24.062
340.3331
NERVONIC ACID (M-H)-
Nervonic acid
ME223284
5281120
-
24.133
366.3488
TRICOSANOIC ACID (M-H)-
Tricosylic acid
ME223281
17085
-
24.356
354.3494
3-METHYLXANTHINE (M-H)-
3-Methylxanthine
ME223341
70639
-
2.436
166.0494
LIGNOCERIC ACID (M-H)-
Lignoceric acid
ME223280
11197
-
24.704
368.3652
PHENYLALANINE (M-H)-
Phenylalanine
ME223267
6140
-
2.486
165.0785
PANTOTHENIC ACID (M+Cl)-
Pantothenic acid
ME223264
6613
-
3.196
219.1105
PANTOTHENIC ACID (M-H)-
Pantothenic acid
ME223320
6613
-
3.197
219.1106
2-HYDROXY-3-METHYLBUTYRIC ACID (M-H)-
2-Hydroxy-3-methylbutyric acid
ME223262
853180
-
3.41
118.0627
ADIPIC ACID (M-H)-
Adipic acid
ME223273
196
-
3.578
146.0582
TRYPTOPHAN (M-H)-
Tryptophan
ME223294
6305
-
3.599
204.0865
L-TRYPTOPHAN-15N2 [ISTD] (M-H)-
Tryptophan
ME223293
16217285
-
3.607
206.0838
3-(4-HYDROXYPHENYL)LACTIC ACID (M-H)-
Hydroxyphenyllactic acid
ME223338
440177
-
3.755
182.0578
ZEATIN [ISTD] (M+Cl)-
trans-Zeatin
ME223312
449093
-
3.875
219.112
4-HYDROXYBENZOIC ACID (M-H)-
4-Hydroxybenzoic acid
ME223285
135
-
4.068
138.0315
THEOPHYLLINE (M-H)-
Theophylline
ME223263
2153
-
4.4
180.0631
5'-METHYLTHIOADENOSINE (M+Cl)-
5'-Methylthioadenosine
ME223345
439176
-
4.458
297.0889
HIPPURIC ACID (M-H)-
Hippuric acid
ME223274
464
-
4.718
179.0581
PHTHALIC ACID (M-H)-
Phthalic acid
ME223334
1017
-
4.722
166.0256
BENZOIC ACID (M-H)-
Benzoic acid
ME223272
243
-
4.906
122.0366
L-[15N]ANTHRANILIC ACID [ISTD] (M-H)-
2-Aminobenzoic acid
ME223316
227
-
5.287
138.0446
4-NITROPHENOL (M-H)-
4-Nitrophenol
ME223303
980
-
6.991
139.0267
SALICYLATE #2 (M-H)-
Salicylic acid
ME223327
338
-
8.134
138.0316
SUBERIC ACID (M-H)-
Suberic acid
ME223260
10457
-
8.145
174.0884
MANDELIC ACID #2 (M-H)-
Mandelic acid
ME223311
11914
-
8.648
152.0475
Analysis: C18 POSITIVE ION MODE/QTOF
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
HISTAMINE (M+H)+
Histamine
ME223454
774
-
0.555
111.0799
ORNITHINE (M+H)+
Ornithine
ME223404
6262
-
0.561
132.0901
LYSINE (M+H)+
Lysine
ME223421
5962
-
0.562
146.1055
3-METHYLHISTAMINE (M+H)+
3-Methylhistamine
ME223448
69520
-
0.564
125.0941
HISTAMINE (M+Na)+
Histamine
ME223451
774
-
0.573
111.0796
LYSINE (M+Na)+
Lysine
ME223407
5962
-
0.576
146.1046
L-HISTIDINE (M+H)+
Histidine
ME223445
6274
-
0.625
155.068
L-HISTIDINE (M+Na)+
Histidine
ME223446
6274
-
0.627
155.0685
CITRULLINE (M+Na)+
Citrulline
ME223467
9750
-
0.63
175.0962
BETA-ALANYL-N(PAI)-METHYL-L-HISTIDINE (M+H)+
Anserine
ME223460
112072
-
0.632
240.119
CARNOSINE (M+Na)+
Carnosine
ME223366
439224
-
0.632
226.1035
L-ARGININE (M+H)+
Arginine
ME223439
6322
-
0.632
174.1106
CARNOSINE (M+H)+
Carnosine
ME223466
439224
-
0.634
226.1044
L-ARGININE (M+Na)+
Arginine
ME223385
6322
-
0.642
174.1084
N6,N6,N6-TRIMETHYL-L-LYSINE (M+H)+
N-6-Trimethyllysine
ME223472
440120
-
0.651
188.1523
FLUCYTOSINE (M+H)+
Flucytosine
ME223389
3366
-
0.652
129.0349
GLUCOSE (M+Na)+
Glucose
ME223372
5793
-
0.664
180.0624
NORADRENALINE (M+H)+[-H2O]
Xi-Norepinephrine
ME223457
951
-
0.669
169.0728
CARNITINE (M+H)+
Carnitine
ME223444
10917
-
0.681
161.104
SN-GLYCERO-3-PHOSPHOCHOLINE (M+H)+
sn-Glycero-3-phosphocholine
ME223403
439285
-
0.681
257.1025
CREATINE (M+H)+
Creatine
ME223450
586
-
0.696
131.0688
3-DEHYDROXYCARNITINE (M+H)+
3-Dehydroxycarnitine
ME223452
725
-
0.7
145.1089
PROLINE (M+H)+
Proline
ME223406
145742
-
0.711
115.0629
METHYL BETA-D-GALACTOSIDE (M+Na)+
Methyl beta-D-galactoside
ME223370
94214
-
0.714
194.0793
TRIMETHYLAMINE (M+H)+
Trimethylamine
ME223458
1146
-
0.717
59.0732
N-ALPHA-ACETYL-L-LYSINE (M+H)+
N(2)-Acetyllysine
ME223455
92907
-
0.721
188.1179
5-AMINOPENTANOIC ACID (M+H)+
5-Aminopentanoic acid
ME223464
138
-
0.736
117.0783
N-ACETYL-DL-SERINE (M+H)+
N-Acetylserine
ME223453
65249
-
0.775
147.0557
N-ACETYL-DL-SERINE (M+H)+[-H2O]
N-Acetylserine
ME223424
65249
-
0.827
147.0534
PHOSPHOCREATINE (M+H)+
Phosphocreatine
ME223469
9548602
-
0.881
211.0352
VALINE (M+H)+
Valine
ME223361
6287
-
0.91
117.0789
GUANINE (M+H)+
Guanine
ME223468
764
-
0.916
151.0489
1-AMINOCYCLOPROPANE-1-CARBOXYLIC ACID (M+H)+
1-Aminocyclopropanecarboxylic acid
ME223411
535
-
0.978
101.0473
ACETYLCARNITINE (M+H)+
CAR 2:0
ME223437
18230
-
0.978
203.1151
INOSINE 5'-PHOSPHATE (M+Na)+
IMP
ME223371
8582
-
0.986
348.0468
INOSINE 5'-PHOSPHATE (M+H)+
IMP
ME223364
8582
-
0.992
348.047
METHIONINE (M+H)+
Methionine
ME223428
6137
-
1.012
149.0506
PYRIDOXAL (M+H)+[-H2O]
Pyridoxal
ME223426
1050
-
1.012
167.0608
HYPOXANTHINE (M+H)+
Hypoxanthine
ME223438
790
-
1.021
136.0385
NAD (M+H)+
NAD+
ME223430
5893
-
1.03
663.1081
CITRIC ACID (M+Na)+
Citric acid
ME223375
311
-
1.033
192.0254
URIC ACID (M+H)+
Uric acid
ME223376
1175
-
1.047
168.0269
AZELAIC ACID (M+Na)+
Azelaic acid
ME223380
2266
-
10.654
188.1067
AZELAIC ACID (M+H)+[-H2O]
Azelaic acid
ME223427
2266
-
10.656
188.1052
NICOTINAMIDE (M+H)+
Niacinamide
ME223395
936
-
1.103
122.0479
OCTANOYLCARNITINE (*) (M+H)+
CAR 8:0
ME223373
123701
-
11.761
287.2109
OPHTHALMIC ACID (M+H)+
Ophthalmic acid
ME223462
7018721
-
1.208
289.1262
IBUPROFEN CARBOXYLIC ACID (M+Na)+
-
ME223397
10444113
-
12.898
236.1055
CORTISONE (M+H)+
Cortisone
ME223382
222786
-
13.325
360.191
CORTISONE (M+Na)+
Cortisone
ME223418
222786
-
13.327
360.1987
TYROSINE (M+H)+
Tyrosine
ME223396
6057
-
1.348
181.0738
GLUTATHIONE OXIDIZED (M+H2)+2
Glutathione
ME223463
65359
-
1.356
612.1534
URIDINE (M+Na)+
Uridine
ME223374
6029
-
1.358
244.0676
CORTISOL (M+H)+
Cortisol
ME223362
5754
-
13.734
362.2071
CORTISOL (M+Na)+
Cortisol
ME223394
5754
-
13.739
362.2047
DEHYDROEPIANDROSTERONE SULFATE M+[-HSO4]
Dehydroepiandrosterone sulfate
ME223368
12594
-
14.937
368.1642
LEUCINE (M+H)+
Leucine
ME223363
6106
-
1.52
131.0948
CORTICOSTERONE (M+Na)+
Corticosterone
ME223420
5753
-
15.316
346.2162
S-ADENOSYL-L-HOMOCYSTEINE (M+H)+
S-Adenosylhomocysteine
ME223409
439155
-
1.551
384.1237
NAPROXEN (M+H)+
Naproxen
ME223392
156391
-
15.701
230.0945
3-HYDROXYLAUROYLCARNITINE (*) (M+H)+
CAR 12:0;OH
ME223435
71464535
-
15.999
359.2677
THYROXINE (M+H)+
Thyroxine
ME223369
5819
-
16.22
776.6859
DODECENOYLCARNITINE (*) II M+
CAR 12:1
ME223393
53481671
-
16.723
342.2637
PROPIONYLCARNITINE (*) (M+H)+
CAR 3:0
ME223416
107738
-
1.673
217.1316
DEHYDROEPIANDROSTERONE (M+H)+
Dehydroepiandrosterone
ME223390
5881
-
17.265
288.2067
INOSINE (M+Na)+
Inosine
ME223417
6021
-
1.734
268.0813
GUANOSINE (M+H)+
Guanosine
ME223459
6802
-
1.833
283.0927
BILIVERDIN (M+H)+
Biliverdin
ME223399
5280353
-
18.613
582.248
GLYCOCHOLIC ACID (M+H)+
Glycocholic acid
ME223432
10140
-
18.8
465.3093
TETRADECENOYLCARNITINE (*) M+
CAR 14:1
ME223402
22833575
-
18.839
370.2964
3',5'-CYCLIC AMP (M+H)+
3',5' cyclic AMP
ME223474
6076
-
1.921
329.0537
5ALPHA-ANDROSTANE-3ALPHA,17BETA-DIOL (M+Na)+
3alpha-Androstanediol
ME223473
15818
-
19.418
292.2412
3-METHOXYTYROSINE (M+H)+
3-Methoxytyrosine
ME223433
9307
-
2.005
211.0843
EICOSADIENOYLCARNITINE (*) (M+H)+
CAR 20:2
ME223470
71464509
-
21.461
451.3592
KYNURENINE (M+H)+
Kynurenine
ME223386
161166
-
2.204
208.0808
EICOSANOYLCARNITINE (*) (M+H)+
CAR 20:0
ME223384
53477833
-
22.067
455.3973
GLYCEROL MYRISTATE (M+Na)+
MG 14:0
ME223415
79050
-
22.145
302.2448
16:0 LYSO PC (M+H)+
LPC 16:0
ME223379
460602
-
22.252
495.3327
16:0 LYSO PC (M+Na)+
LPC 16:0
ME223440
460602
-
22.266
495.3334
OLEIC ACID (M+Na)+
Oleic acid
ME223388
445639
-
22.536
282.2568
OLEAMIDE (M+H)+
Oleamide
ME223398
5283387
-
22.622
281.2709
OLEAMIDE (M+Na)+
Oleamide
ME223449
5283387
-
22.623
281.2724
OLEOYL-GLYCEROL (M+H)+
MG 18:1
ME223410
5319879
-
22.675
356.2903
18:0 LYSO-PE (M+H)+
LPE 18:0
ME223465
9547068
-
22.689
481.3214
18:0 LYSO-PE (M+Na)+
LPE 18:0
ME223456
9547068
-
22.69
481.3249
OLEOYL-GLYCEROL (M+Na)+
MG 18:1
ME223429
5319879
-
22.713
356.2933
DECANOIC ACID (2M+Na)+
Capric acid
ME223423
2969
-
22.812
172.1465
BIS(2-ETHYLHEXYL)PHTHALIC ACID (M+Na)+
bis(2-Ethylhexyl)phthalic acid
ME223387
8343
-
23.106
390.278
DESMOSTEROL (M+H)+[-H2O]
Desmosterol
ME223360
439577
-
24.234
384.339
ALPHA-TOCOPHEROL (M+H)+
alpha-Tocopherol
ME223425
14985
-
24.474
430.3794
CHOLESTEROL (M+H)+[-H2O]
Cholesterol
ME223378
5997
-
24.542
386.3551
PHENYLALANINE (M+H)+
Phenylalanine
ME223443
6140
-
2.528
165.079
DIPALMITOYL-GLYCEROL (M+Na)+
DG 16:0_16:0
ME223401
644078
-
26.06
568.5075
DIPALMITOYL-GLYCEROL (M+H)+[-H2O]
DG 16:0_16:0
ME223408
644078
-
26.061
568.5064
ISO-BUTYRYLCARNITINE (*) (M+H)+
CAR 3:0;2Me
ME223359
168379
-
2.912
231.1475
1-METHYLADENOSINE (M+H)+
1-Methyladenosine
ME223377
27476
-
2.99
281.1143
PANTOTHENIC ACID (M+H)+
Pantothenic acid
ME223391
6613
-
3.202
219.1114
PANTOTHENIC ACID (M+Na)+
Pantothenic acid
ME223441
6613
-
3.202
219.1114
THEOBROMINE (M+H)+
Theobromine
ME223383
5429
-
3.481
180.0656
ADIPIC ACID (M+Na)+
Adipic acid
ME223400
196
-
3.483
146.0585
TRYPTOPHAN (M+H)+
Tryptophan
ME223414
6305
-
3.587
204.0867
TRYPTOPHAN (M+Na)+
Tryptophan
ME223405
6305
-
3.587
204.087
L-TRYPTOPHAN-15N2 [ISTD] (M+H)+
Tryptophan
ME223412
16217285
-
3.606
206.0847
ZEATIN [ISTD] (M+H)+
trans-Zeatin
ME223381
449093
-
3.881
219.113
5'-METHYLTHIOADENOSINE (M+H)+
5'-Methylthioadenosine
ME223461
439176
-
4.463
297.0902
ISOVALERYLCARNITINE (*) (M+H)+
CAR 4:0;3Me
ME223365
169235
-
4.583
245.1629
HIPPURIC ACID (M+H)+
Hippuric acid
ME223419
464
-
4.731
179.0588
KYNURENIC ACID (M+H)+
Kynurenic acid
ME223431
3845
-
4.913
189.0444
CAFFEINE (M+H)+
Caffeine
ME223471
2519
-
5.838
194.0819
HEXANOYLCARNITINE (*) M+
CAR 6:0
ME223434
3246939
-
7.06
260.1885
N-CYCLOHEXYLFORMAMIDE (M+H)+
N-Cyclohexylformamide
ME223413
13017
-
7.811
127.1006
N-ACETYL-D-TRYPTOPHAN (M+H)+
N-Acetyl-D-tryptophan
ME223442
439917
-
7.895
246.0984
N-ACETYL-D-TRYPTOPHAN (M+Na)+
N-Acetyl-D-tryptophan
ME223447
439917
-
7.902
246.103
SUBERIC ACID (M+Na)+
Suberic acid
ME223422
10457
-
8.162
174.0915
INDOLE-3-ACETIC ACID (M+H)+
Indoleacetic acid
ME223436
802
-
8.332
175.0642
OCTENOYLCARNITINE (*) M+
CAR 8:1
ME223367
71464472
-
9.587
286.2027
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
lysoPE 16:1; [M-H]-@1.20
LPE 16:1
ME223732
-
-
1.2
450.2621
lysoPE 22:6; [M-H]-@1.29
LPE 22:6
ME223739
-
-
1.29
524.2777
PC 19:2; [M-Ac-H]-@1.32
PC 19:2
ME223543
-
-
1.32
606.3407
lysoPE 20:3; [M-H]-@1.61
LPE 20:3
ME223735
-
-
1.61
502.2934
lysoPE 20:3; [M-H]-@1.64
LPE 20:3
ME223736
-
-
1.64
502.2934
lysoPE 16:0; [M-H]-@1.66
LPE 16:0
ME223731
-
-
1.66
452.2777
lysoPE 22:5; [M-H]-@1.72
LPE 22:5
ME223738
-
-
1.72
526.2934
lysoPE 18:1; [M-H]-@1.75
LPE 18:1
ME223734
-
-
1.75
478.2934
Arachidonic acid
Arachidonic acid
ME223475
444899
-
1.76
303.2329
FFA(18:2)
Octadecadienoic acid
ME223519
-
-
1.84
279.2329
lysoPE 22:4; [M-H]-@1.86
LPE 22:4
ME223737
-
-
1.86
528.309
FFA(16:0)
Palmitic acid
ME223516
-
-
2.18
255.2329
FFA(18:1)
Octadecenoic acid
ME223518
-
-
2.4
281.2486
lysoPE 18:0; [M-H]-@2.44
LPE 18:0
ME223733
-
-
2.44
480.309
FFA(20:2)
Eicosadienoic acid
ME223522
-
-
2.64
307.2642
FFA(22:3)
Docosatrienoic acid
ME223526
-
-
2.99
333.2799
FFA(18:0)
Stearic acid
ME223517
5281
-
3.13
283.2642
FFA(20:1)
Heneicosenoic acid
ME223521
-
-
3.3
309.2799
FFA(22:2)
Docosadienoic acid
ME223525
-
-
3.59
335.2955
FFA(24:3)
Tetracosatrienoic acid
ME223530
52921854
-
3.99
361.3112
FFA(20:0)
Arachidic acid
ME223520
10467
-
4.17
311.2955
FFA(22:1)
Docosenoic acid
ME223524
-
-
4.28
337.3112
FFA(24:2)
Tetracosadienoic acid
ME223529
-
-
4.57
363.3268
PC 26:0; [M-Ac-H]-@4.59
PC 26:0
ME223544
-
-
4.59
708.4816
PC 30:2; [M-Ac-H]-@4.87
PC 30:2
ME223549
-
-
4.87
760.5129
PG 36:4; [M-H]-@4.95
PG 36:4
ME223690
-
-
4.95
769.5019
PS 40:8; [M-H]-@4.98
PS 40:8
ME223730
-
-
4.98
830.4972
PI 32:1; [M-H]-@5.04
PI 32:1
ME223693
-
-
5.04
807.5024
CerP 32:1; [M-H]-@5.12
CerP 32:1;O2
ME223505
-
-
5.12
588.4393
PI 38:6; [M-H]-@5.13
PI 38:6
ME223712
-
-
5.13
881.518
FFA(22:0)
Behenic acid
ME223523
8215
-
5.17
339.3268
PC 28:0; [M-Ac-H]-@5.21
PC 28:0
ME223545
-
-
5.21
736.5129
FFA(24:1)
Tetracosenoic acid
ME223528
-
-
5.22
365.3425
PI 36:4; [M-H]-@5.24
PI 36:4
ME223704
-
-
5.24
857.518
PC 28:0; [M-Ac-H]-@5.26
PC 28:0
ME223546
-
-
5.26
736.5129
PI 34:2; [M-H]-@5.26
PI 34:2
ME223696
-
-
5.26
833.518
PI 36:4; [M-H]-@5.26
PI 36:4
ME223705
-
-
5.26
857.518
CerP 34:2; [M-H]-@5.29
CerP 34:2;O2
ME223509
-
-
5.29
614.4549
PG 36:3; [M-H]-@5.30
PG 36:3
ME223689
-
-
5.3
771.5176
PI 34:2; [M-H]-@5.30
PI 34:2
ME223697
-
-
5.3
833.518
PI 38:5; [M-H]-@5.35
PI 38:5
ME223710
-
-
5.35
883.5337
PS 34:2; [M-H]-@5.36
PS 34:2
ME223718
-
-
5.36
758.4972
PI 36:3; [M-H]-@5.43
PI 36:3
ME223703
-
-
5.43
859.5337
PI 38:5; [M-H]-@5.43
PI 38:5
ME223711
-
-
5.43
883.5337
PC 30:1; [M-Ac-H]-@5.44
PC 30:1
ME223548
-
-
5.44
762.5285
PG 34:2; [M-H]-@5.45
PG 34:2
ME223682
-
-
5.45
745.5019
PS 40:7; [M-H]-@5.45
PS 40:7
ME223729
-
-
5.45
832.5129
PG 34:2; [M-H]-@5.46
PG 34:2
ME223683
-
-
5.46
745.5019
CerP 33:1; [M-H]-@5.49
CerP 33:1;O2
ME223506
-
-
5.49
602.4549
PG 38:5; [M-H]-@5.50
PG 38:5
ME223692
-
-
5.5
795.5176
PC 33:3; [M-Ac-H]-@5.51
PC 33:3
ME223560
-
-
5.51
800.5442
PC 38:7; [M-Ac-H]-@5.51
PC 38:7
ME223589
-
-
5.51
862.5598
PC 29:0; [M-Ac-H]-@5.54
PC 29:0
ME223547
-
-
5.54
750.5285
PC 32:2; [M-Ac-H]-@5.54
PC 32:2
ME223555
-
-
5.54
788.5442
PS 36:3; [M-H]-@5.54
PS 36:3
ME223721
-
-
5.54
784.5129
PC 34:4; [M-Ac-H]-@5.55
PC 34:4
ME223564
-
-
5.55
812.5442
PS 38:5; [M-H]-@5.57
PS 38:5
ME223725
-
-
5.57
808.5129
PC 38:7; [M-Ac-H]-@5.58
PC 38:7
ME223590
-
-
5.58
862.5598
PI 35:2; [M-H]-@5.59
PI 35:2
ME223698
-
-
5.59
847.5337
PC 32:2; [M-Ac-H]-@5.61
PC 32:2
ME223556
-
-
5.61
788.5442
PC 42:10; [M-Ac-H]-@5.68
PC 42:10
ME223602
-
-
5.68
912.5754
PC 36:5; [M-Ac-H]-@5.69
PC 36:5
ME223573
-
-
5.69
838.5598
PE 34:4; [M-H]-@5.70
PE 34:4
ME223623
-
-
5.7
710.4761
PI 34:1; [M-H]-@5.70
PI 34:1
ME223694
-
-
5.7
835.5337
PE 37:5; [M-H]-@5.71
PE 37:5
ME223644
-
-
5.71
750.5074
PI 34:1; [M-H]-@5.71
PI 34:1
ME223695
-
-
5.71
835.5337
PE 34:4; [M-H]-@5.72
PE 34:4
ME223624
-
-
5.72
710.4761
PE 38:5; [M-H]-@5.72
PE 38:5
ME223653
-
-
5.72
764.5231
PE 32:2; [M-H]-@5.74
PE 32:2
ME223612
-
-
5.74
686.4761
PG 32:0; [M-H]-@5.74
PG 32:0
ME223677
-
-
5.74
721.5019
PC 31:1; [M-Ac-H]-@5.76
PC 31:1
ME223551
-
-
5.76
776.5442
PE 38:7; [M-H]-@5.76
PE 38:7
ME223658
-
-
5.76
760.4917
PC 37:6; [M-Ac-H]-@5.79
PC 37:6
ME223582
-
-
5.79
850.5598
PC 40:8; [M-Ac-H]-@5.79
PC 40:8
ME223601
-
-
5.79
888.5754
plasmenyl-PE 28:0; [M-H]-@5.79
PE P-28:0
ME223740
-
-
5.79
618.4499
PC 34:3; [M-Ac-H]-@5.80
PC 34:3
ME223563
-
-
5.8
814.5598
PG 32:0; [M-H]-@5.80
PG 32:0
ME223678
-
-
5.8
721.5019
PI 40:6; [M-H]-@5.80
PI 40:6
ME223716
-
-
5.8
909.5493
CerP 34:1; [M-H]-@5.83
CerP 34:1;O2
ME223507
-
-
5.83
616.4706
CerP 34:1; [M-H]-@5.84
CerP 34:1;O2
ME223508
-
-
5.84
616.4706
PG 34:1; [M-H]-@5.84
PG 34:1
ME223681
-
-
5.84
747.5176
PI 40:6; [M-H]-@5.84
PI 40:6
ME223717
-
-
5.84
909.5493
PE 40:8; [M-H]-@5.85
PE 40:8
ME223671
-
-
5.85
786.5074
PI 38:4; [M-H]-@5.86
PI 38:4
ME223708
-
-
5.86
885.5493
PI 38:4; [M-H]-@5.87
PI 38:4
ME223709
-
-
5.87
885.5493
PI 36:2; [M-H]-@5.88
PI 36:2
ME223701
-
-
5.88
861.5493
PS 40:6; [M-H]-@5.88
PS 40:6
ME223728
-
-
5.88
834.5285
PC 42:9; [M-Ac-H]-@5.90
PC 42:9
ME223603
-
-
5.9
914.5911
CL 70:5; [M-2H](2-)@5.92
CL 70:5
ME223479
-
-
5.92
712.4861
PI 36:2; [M-H]-@5.92
PI 36:2
ME223702
-
-
5.92
861.5493
PA 38:5; [M-H]-@5.95
PA 38:5
ME223540
-
-
5.95
721.4808
PE 36:5; [M-H]-@5.95
PE 36:5
ME223638
-
-
5.95
736.4917
CL 70:5; [M-2H](2-)@5.96
CL 70:5
ME223480
-
-
5.96
712.4861
PC 33:2; [M-Ac-H]-@5.96
PC 33:2
ME223559
-
-
5.96
802.5598
PE 37:6; [M-H]-@5.96
PE 37:6
ME223645
-
-
5.96
748.4917
PE 40:8; [M-H]-@5.96
PE 40:8
ME223672
-
-
5.96
786.5074
PS 38:4; [M-H]-@5.97
PS 38:4
ME223723
-
-
5.97
810.5285
PC 37:5; [M-Ac-H]-@5.98
PC 37:5
ME223580
-
-
5.98
852.5754
PE 34:3; [M-H]-@5.98
PE 34:3
ME223621
-
-
5.98
712.4917
CL 74:5; [M-2H](2-)@5.99
CL 74:5
ME223493
-
-
5.99
740.5174
PE 36:5; [M-H]-@6.01
PE 36:5
ME223639
-
-
6.01
736.4917
PI 40:5; [M-H]-@6.01
PI 40:5
ME223714
-
-
6.01
911.5649
PS 36:2; [M-H]-@6.01
PS 36:2
ME223720
-
-
6.01
786.5285
PS 38:4; [M-H]-@6.01
PS 38:4
ME223724
-
-
6.01
810.5285
CL 70:1; [M-2H](2-)@6.02
CL 70:1
ME223477
-
-
6.02
716.5174
PC 38:6; [M-Ac-H]-@6.02
PC 38:6
ME223588
-
-
6.02
864.5754
PE 34:3; [M-H]-@6.03
PE 34:3
ME223622
-
-
6.03
712.4917
PC 32:1; [M-Ac-H]-@6.05
PC 32:1
ME223553
-
-
6.05
790.5598
PC 37:5; [M-Ac-H]-@6.06
PC 37:5
ME223581
-
-
6.06
852.5754
PE 35:4; [M-H]-@6.06
PE 35:4
ME223630
-
-
6.06
724.4917
PG 38:4; [M-H]-@6.06
PG 38:4
ME223691
-
-
6.06
797.5333
FFA(24:0)
Lignoceric acid
ME223527
11197
-
6.07
367.3581
PE 35:4; [M-H]-@6.07
PE 35:4
ME223631
-
-
6.07
724.4917
PE 38:6; [M-H]-@6.07
PE 38:6
ME223656
-
-
6.07
762.5074
PG 33:0; [M-H]-@6.07
PG 33:0
ME223679
-
-
6.07
735.5176
PI 38:3; [M-H]-@6.07
PI 38:3
ME223706
-
-
6.07
887.5649
PC 40:7; [M-Ac-H]-@6.08
PC 40:7
ME223599
-
-
6.08
890.5911
PE 30:0; [M-H]-@6.08
PE 30:0
ME223606
-
-
6.08
662.4761
PE 33:2; [M-H]-@6.08
PE 33:2
ME223615
-
-
6.08
700.4917
PG 36:2; [M-H]-@6.08
PG 36:2
ME223687
-
-
6.08
773.5333
PA 38:6; [M-H]-@6.09
PA 38:6
ME223541
-
-
6.09
719.4652
PE 30:0; [M-H]-@6.09
PE 30:0
ME223607
-
-
6.09
662.4761
PE 33:2; [M-H]-@6.09
PE 33:2
ME223616
-
-
6.09
700.4917
PG 33:0; [M-H]-@6.09
PG 33:0
ME223680
-
-
6.09
735.5176
CL 74:7; [M-2H](2-)@6.10
CL 74:7
ME223494
-
-
6.1
738.5018
CL 78:3; [M-2H](2-)@6.10
CL 78:3
ME223500
-
-
6.1
770.5644
PC 32:1; [M-Ac-H]-@6.10
PC 32:1
ME223554
-
-
6.1
790.5598
PI 38:3; [M-H]-@6.10
PI 38:3
ME223707
-
-
6.1
887.5649
CL 70:1; [M-2H](2-)@6.12
CL 70:1
ME223478
-
-
6.12
716.5174
PA 38:6; [M-H]-@6.12
PA 38:6
ME223542
-
-
6.12
719.4652
PS 40:5; [M-H]-@6.12
PS 40:5
ME223727
-
-
6.12
836.5442
PG 35:1; [M-H]-@6.13
PG 35:1
ME223684
-
-
6.13
761.5333
PG 36:2; [M-H]-@6.13
PG 36:2
ME223688
-
-
6.13
773.5333
CerP 35:1; [M-H]-@6.15
CerP 35:1;O2
ME223510
-
-
6.15
630.4863
PI 40:5; [M-H]-@6.15
PI 40:5
ME223715
-
-
6.15
911.5649
PA 35:1; [M-H]-@6.16
PA 35:1
ME223534
-
-
6.16
687.4965
PE 38:6; [M-H]-@6.17
PE 38:6
ME223657
-
-
6.17
762.5074
PA 36:3; [M-H]-@6.18
PA 36:3
ME223536
-
-
6.18
697.4808
PC 31:0; [M-Ac-H]-@6.18
PC 31:0
ME223550
-
-
6.18
778.5598
PC 34:2; [M-Ac-H]-@6.19
PC 34:2
ME223562
-
-
6.19
816.5754
PA 34:2; [M-H]-@6.21
PA 34:2
ME223532
-
-
6.21
671.4652
PE 32:1; [M-H]-@6.21
PE 32:1
ME223610
-
-
6.21
688.4917
CL 66:1; [M-2H](2-)@6.22
CL 66:1
ME223476
-
-
6.22
688.4861
PE 35:3; [M-H]-@6.22
PE 35:3
ME223628
-
-
6.22
726.5074
PS 38:3; [M-H]-@6.22
PS 38:3
ME223722
-
-
6.22
812.5442
CL 72:5; [M-2H](2-)@6.23
CL 72:5
ME223485
-
-
6.23
726.5018
PA 36:4; [M-H]-@6.23
PA 36:4
ME223538
-
-
6.23
695.4652
PE 32:1; [M-H]-@6.23
PE 32:1
ME223611
-
-
6.23
688.4917
PE 35:3; [M-H]-@6.23
PE 35:3
ME223629
-
-
6.23
726.5074
PA 36:3; [M-H]-@6.24
PA 36:3
ME223537
-
-
6.24
697.4808
PE 36:4; [M-H]-@6.24
PE 36:4
ME223637
-
-
6.24
738.5074
PA 34:2; [M-H]-@6.26
PA 34:2
ME223533
-
-
6.26
671.4652
PC 40:7; [M-Ac-H]-@6.27
PC 40:7
ME223600
-
-
6.27
890.5911
CL 82:13; [M-2H](2-)@6.29
CL 82:13
ME223503
-
-
6.29
788.5174
PI 36:1; [M-H]-@6.30
PI 36:1
ME223699
-
-
6.3
863.5649
plasmenyl-PE 34:3; [M-H]-@6.31
PE P-34:3
ME223749
-
-
6.31
696.4968
PC 36:3; [M-Ac-H]-@6.32
PC 36:3
ME223571
-
-
6.32
842.5911
PE 40:5; [M-H]-@6.32
PE 40:5
ME223666
-
-
6.32
792.5543
PI 36:1; [M-H]-@6.32
PI 36:1
ME223700
-
-
6.32
863.5649
plasmenyl-PE 36:5; [M-H]-@6.32
PE P-36:5
ME223760
-
-
6.32
720.4968
PI 40:4; [M-H]-@6.33
PI 40:4
ME223713
-
-
6.33
913.5806
PC 39:6; [M-Ac-H]-@6.36
PC 39:6
ME223593
-
-
6.36
878.5911
PE 40:7; [M-H]-@6.36
PE 40:7
ME223669
-
-
6.36
788.5231
PA 37:2; [M-H]-@6.37
PA 37:2
ME223539
-
-
6.37
713.5121
PC 38:5; [M-Ac-H]-@6.37
PC 38:5
ME223587
-
-
6.37
866.5911
plasmenyl-PE 34:3; [M-H]-@6.37
PE P-34:3
ME223750
-
-
6.37
696.4968
CL 78:5; [M-2H](2-)@6.38
CL 78:5
ME223501
-
-
6.38
768.5487
PC 36:3; [M-Ac-H]-@6.40
PC 36:3
ME223572
-
-
6.4
842.5911
PE 34:2; [M-H]-@6.41
PE 34:2
ME223620
-
-
6.41
714.5074
PE 40:7; [M-H]-@6.41
PE 40:7
ME223670
-
-
6.41
788.5231
CL 78:5; [M-2H](2-)@6.42
CL 78:5
ME223502
-
-
6.42
768.5487
PC 33:1; [M-Ac-H]-@6.43
PC 33:1
ME223558
-
-
6.43
804.5754
PS 36:1; [M-H]-@6.43
PS 36:1
ME223719
-
-
6.43
788.5442
PS 40:4; [M-H]-@6.43
PS 40:4
ME223726
-
-
6.43
838.5598
plasmenyl-PE 30:0; [M-H]-@6.45
PE P-30:0
ME223741
-
-
6.45
646.4812
PC 37:4; [M-Ac-H]-@6.49
PC 37:4
ME223578
-
-
6.49
854.5911
PE 38:5; [M-H]-@6.49
PE 38:5
ME223654
-
-
6.49
764.5231
PE 38:5; [M-H]-@6.50
PE 38:5
ME223655
-
-
6.5
764.5231
PC 39:5; [M-Ac-H]-@6.51
PC 39:5
ME223592
-
-
6.51
880.6068
PC 37:4; [M-Ac-H]-@6.52
PC 37:4
ME223579
-
-
6.52
854.5911
PE 36:3; [M-H]-@6.52
PE 36:3
ME223635
-
-
6.52
740.5231
PC 35:2; [M-Ac-H]-@6.53
PC 35:2
ME223567
-
-
6.53
830.5911
PE 34:0; [M-H]-@6.53
PE 34:0
ME223617
-
-
6.53
718.5387
PE 36:3; [M-H]-@6.54
PE 36:3
ME223636
-
-
6.54
740.5231
plasmenyl-PE 38:6; [M-H]-@6.54
PE P-38:6
ME223766
-
-
6.54
746.5124
PE 33:1; [M-H]-@6.55
PE 33:1
ME223614
-
-
6.55
702.5074
plasmenyl-PE 38:6; [M-H]-@6.56
PE P-38:6
ME223767
-
-
6.56
746.5124
plasmenyl-PE 32:1; [M-H]-@6.58
PE P-32:1
ME223743
-
-
6.58
672.4968
PC 32:0; [M-Ac-H]-@6.62
PC 32:0
ME223552
-
-
6.62
792.5754
PE 37:2; [M-H]-@6.62
PE 37:2
ME223640
-
-
6.62
756.5543
PE 34:0; [M-H]-@6.63
PE 34:0
ME223618
-
-
6.63
718.5387
PC 40:6; [M-Ac-H]-@6.65
PC 40:6
ME223598
-
-
6.65
892.6068
plasmenyl-PE 36:4; [M-H]-@6.65
PE P-36:4
ME223759
-
-
6.65
722.5124
PE 37:4; [M-H]-@6.66
PE 37:4
ME223643
-
-
6.66
752.5231
CL 74:1; [M-2H](2-)@6.67
CL 74:1
ME223491
-
-
6.67
744.5487
PC 34:1; [M-Ac-H]-@6.67
PC 34:1
ME223561
-
-
6.67
818.5911
plasmenyl-PE 34:2; [M-H]-@6.67
PE P-34:2
ME223748
-
-
6.67
698.5124
PE 32:0; [M-H]-@6.68
PE 32:0
ME223608
-
-
6.68
690.5074
PE 35:2; [M-H]-@6.69
PE 35:2
ME223627
-
-
6.69
728.5231
CL 76:7; [M-2H](2-)@6.70
CL 76:7
ME223499
-
-
6.7
752.5174
PA 34:1; [M-H]-@6.70
PA 34:1
ME223531
-
-
6.7
673.4808
PC 37:3; [M-Ac-H]-@6.70
PC 37:3
ME223576
-
-
6.7
856.6068
CL 74:1; [M-2H](2-)@6.72
CL 74:1
ME223492
-
-
6.72
744.5487
PE 32:0; [M-H]-@6.73
PE 32:0
ME223609
-
-
6.73
690.5074
PC 37:3; [M-Ac-H]-@6.74
PC 37:3
ME223577
-
-
6.74
856.6068
PC 38:4; [M-Ac-H]-@6.75
PC 38:4
ME223586
-
-
6.75
868.6068
plasmenyl-PE 38:5; [M-H]-@6.75
PE P-38:5
ME223765
-
-
6.75
748.5281
CL 72:3; [M-2H](2-)@6.76
CL 72:3
ME223484
-
-
6.76
728.5174
PE 38:2; [M-H]-@6.83
PE 38:2
ME223648
-
-
6.83
770.57
PC 33:0; [M-Ac-H]-@6.84
PC 33:0
ME223557
-
-
6.84
806.5911
PC 36:2; [M-Ac-H]-@6.85
PC 36:2
ME223570
-
-
6.85
844.6068
PE 34:1; [M-H]-@6.85
PE 34:1
ME223619
-
-
6.85
716.5231
PA 36:2; [M-H]-@6.86
PA 36:2
ME223535
-
-
6.86
699.4965
PG 36:0; [M-H]-@6.87
PG 36:0
ME223685
-
-
6.87
777.5646
PE 40:4; [M-H]-@6.88
PE 40:4
ME223664
-
-
6.88
794.57
PE 37:3; [M-H]-@6.89
PE 37:3
ME223642
-
-
6.89
754.5387
PE 38:2; [M-H]-@6.89
PE 38:2
ME223649
-
-
6.89
770.57
plasmenyl-PE 36:3; [M-H]-@6.90
PE P-36:3
ME223757
-
-
6.9
724.5281
PE 40:6; [M-H]-@6.91
PE 40:6
ME223668
-
-
6.91
790.5387
plasmenyl-PE 36:3; [M-H]-@6.91
PE P-36:3
ME223758
-
-
6.91
724.5281
CL 76:5; [M-2H](2-)@6.92
CL 76:5
ME223498
-
-
6.92
754.5331
PG 36:0; [M-H]-@6.93
PG 36:0
ME223686
-
-
6.93
777.5646
PC 35:1; [M-Ac-H]-@6.95
PC 35:1
ME223565
-
-
6.95
832.6068
PE 36:2; [M-H]-@6.97
PE 36:2
ME223634
-
-
6.97
742.5387
PE 38:4; [M-H]-@7.00
PE 38:4
ME223652
-
-
7
766.5387
PE 33:0; [M-H]-@7.03
PE 33:0
ME223613
-
-
7.03
704.5231
PC 35:1; [M-Ac-H]-@7.04
PC 35:1
ME223566
-
-
7.04
832.6068
PE 40:3; [M-H]-@7.05
PE 40:3
ME223662
-
-
7.05
796.5856
PC 40:5; [M-Ac-H]-@7.06
PC 40:5
ME223597
-
-
7.06
894.6224
plasmenyl-PE 32:0; [M-H]-@7.07
PE P-32:0
ME223742
-
-
7.07
674.5124
CL 82:9; [M-2H](2-)@7.08
CL 82:9
ME223504
-
-
7.08
792.5487
PC 38:3; [M-Ac-H]-@7.09
PC 38:3
ME223585
-
-
7.09
870.6224
PC 37:2; [M-Ac-H]-@7.10
PC 37:2
ME223574
-
-
7.1
858.6224
PE 35:1; [M-H]-@7.12
PE 35:1
ME223626
-
-
7.12
730.5387
PE 39:4; [M-H]-@7.12
PE 39:4
ME223659
-
-
7.12
780.5543
PE 40:3; [M-H]-@7.12
PE 40:3
ME223663
-
-
7.12
796.5856
PE 40:5; [M-H]-@7.13
PE 40:5
ME223667
-
-
7.13
792.5543
CL 72:1; [M-2H](2-)@7.15
CL 72:1
ME223483
-
-
7.15
730.5331
PE 37:2; [M-H]-@7.16
PE 37:2
ME223641
-
-
7.16
756.5543
plasmenyl-PE 40:6; [M-H]-@7.17
PE P-40:6
ME223771
-
-
7.17
774.5438
plasmenyl-PE 34:1; [M-H]-@7.19
PE P-34:1
ME223747
-
-
7.19
700.5281
plasmenyl-PE 38:4; [M-H]-@7.19
PE P-38:4
ME223764
-
-
7.19
750.5438
plasmenyl-PE 40:6; [M-H]-@7.20
PE P-40:6
ME223772
-
-
7.2
774.5438
plasmenyl-PE 33:0; [M-H]-@7.21
PE P-33:0
ME223744
-
-
7.21
688.5281
PE 38:3; [M-H]-@7.22
PE 38:3
ME223650
-
-
7.22
768.5543
plasmenyl-PE 34:0; [M-H]-@7.22
PE P-34:0
ME223745
-
-
7.22
702.5438
PC 37:2; [M-Ac-H]-@7.23
PC 37:2
ME223575
-
-
7.23
858.6224
PE 38:3; [M-H]-@7.23
PE 38:3
ME223651
-
-
7.23
768.5543
PE 36:0; [M-H]-@7.26
PE 36:0
ME223632
-
-
7.26
746.57
plasmenyl-PE 36:2; [M-H]-@7.29
PE P-36:2
ME223755
-
-
7.29
726.5438
PC 36:1; [M-Ac-H]-@7.30
PC 36:1
ME223569
-
-
7.3
846.6224
plasmenyl-PE 36:2; [M-H]-@7.31
PE P-36:2
ME223756
-
-
7.31
726.5438
PC 40:4; [M-Ac-H]-@7.32
PC 40:4
ME223596
-
-
7.32
896.6381
CL 76:3; [M-2H](2-)@7.33
CL 76:3
ME223497
-
-
7.33
756.5487
PC 39:3; [M-Ac-H]-@7.33
PC 39:3
ME223591
-
-
7.33
884.6381
PE 38:1; [M-H]-@7.33
PE 38:1
ME223646
-
-
7.33
772.5856
PE 40:4; [M-H]-@7.42
PE 40:4
ME223665
-
-
7.42
794.57
plasmenyl-PE 40:5; [M-H]-@7.42
PE P-40:5
ME223770
-
-
7.42
776.5594
PE 36:1; [M-H]-@7.43
PE 36:1
ME223633
-
-
7.43
744.5543
plasmenyl-PE 35:1; [M-H]-@7.45
PE P-35:1
ME223751
-
-
7.45
714.5438
PC 38:2; [M-Ac-H]-@7.47
PC 38:2
ME223584
-
-
7.47
872.6381
PE 40:2; [M-H]-@7.47
PE 40:2
ME223660
-
-
7.47
798.6013
plasmenyl-PE 38:3; [M-H]-@7.50
PE P-38:3
ME223763
-
-
7.5
752.5594
PE 35:0; [M-H]-@7.56
PE 35:0
ME223625
-
-
7.56
732.5543
PC 40:3; [M-Ac-H]-@7.60
PC 40:3
ME223595
-
-
7.6
898.6537
plasmenyl-PE 34:0; [M-H]-@7.61
PE P-34:0
ME223746
-
-
7.61
702.5438
CerP 42:2; [M-H]-@7.66
CerP 42:2;O2
ME223514
-
-
7.66
726.5801
CerP 40:1; [M-H]-@7.69
CerP 40:1;O2
ME223511
-
-
7.69
700.5645
CerP 42:2; [M-H]-@7.71
CerP 42:2;O2
ME223515
-
-
7.71
726.5801
PC 38:1; [M-Ac-H]-@7.71
PC 38:1
ME223583
-
-
7.71
874.6537
plasmenyl-PE 36:0; [M-H]-@7.71
PE P-36:0
ME223752
-
-
7.71
730.5751
PC 36:0; [M-Ac-H]-@7.72
PC 36:0
ME223568
-
-
7.72
848.6381
plasmenyl-PE 36:1; [M-H]-@7.73
PE P-36:1
ME223754
-
-
7.73
728.5594
plasmenyl-PE 42:6; [M-H]-@7.73
PE P-42:6
ME223776
-
-
7.73
802.5751
plasmenyl-PE 40:4; [M-H]-@7.76
PE P-40:4
ME223769
-
-
7.76
778.5751
plasmenyl-PE 42:6; [M-H]-@7.76
PE P-42:6
ME223777
-
-
7.76
802.5751
PC 40:2; [M-Ac-H]-@7.83
PC 40:2
ME223594
-
-
7.83
900.6694
plasmenyl-PE 42:5; [M-H]-@7.86
PE P-42:5
ME223774
-
-
7.86
804.5907
plasmenyl-PE 38:2; [M-H]-@7.88
PE P-38:2
ME223762
-
-
7.88
754.5751
plasmenyl-PE 42:5; [M-H]-@7.88
PE P-42:5
ME223775
-
-
7.88
804.5907
PE 38:1; [M-H]-@7.89
PE 38:1
ME223647
-
-
7.89
772.5856
plasmenyl-PE 42:4; [M-H]-@8.03
PE P-42:4
ME223773
-
-
8.03
806.6064
PE 42:4; [M-H]-@8.06
PE 42:4
ME223675
-
-
8.06
822.6013
plasmenyl-PE 40:3; [M-H]-@8.07
PE P-40:3
ME223768
-
-
8.07
780.5907
PC 44:5; [M-Ac-H]-@8.09
PC 44:5
ME223605
-
-
8.09
950.685
PE 40:2; [M-H]-@8.09
PE 40:2
ME223661
-
-
8.09
798.6013
plasmenyl-PE 36:0; [M-H]-@8.10
PE P-36:0
ME223753
-
-
8.1
730.5751
CerP 42:1; [M-H]-@8.17
CerP 42:1;O2
ME223512
-
-
8.17
728.5958
plasmenyl-PE 38:1; [M-H]-@8.24
PE P-38:1
ME223761
-
-
8.24
756.5907
CerP 42:1; [M-H]-@8.27
CerP 42:1;O2
ME223513
-
-
8.27
728.5958
PC 44:4; [M-Ac-H]-@8.42
PC 44:4
ME223604
-
-
8.42
952.7007
PE 44:4; [M-H]-@8.52
PE 44:4
ME223676
-
-
8.52
850.6326
PE 42:2; [M-H]-@8.55
PE 42:2
ME223674
-
-
8.55
826.6326
CL 72:9; [M-2H](2-)@8.79
CL 72:9
ME223490
-
-
8.79
722.4705
PE 42:1; [M-H]-@8.83
PE 42:1
ME223673
-
-
8.83
828.6483
CL 70:7; [M-2H](2-)@8.87
CL 70:7
ME223482
-
-
8.87
710.4705
CL 72:8; [M-2H](2-)@8.94
CL 72:8
ME223489
-
-
8.94
723.4783
CL 74:9; [M-2H](2-)@9.04
CL 74:9
ME223496
-
-
9.04
736.4861
CL 70:6; [M-2H](2-)@9.10
CL 70:6
ME223481
-
-
9.1
711.4783
CL 72:7; [M-2H](2-)@9.15
CL 72:7
ME223488
-
-
9.15
724.4861
CL 74:8; [M-2H](2-)@9.20
CL 74:8
ME223495
-
-
9.2
737.4939
CL 72:6; [M-2H](2-)@9.35
CL 72:6
ME223487
-
-
9.35
725.4939
CL 72:5; [M-2H](2-)@9.51
CL 72:5
ME223486
-
-
9.51
726.5018
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
lysoPC 14:0; [M+H]+@1.00
LPC 14:0
ME224211
-
-
1
468.309
TG 52:5; [M+NH4]+@10.02
TG 52:5
ME224116
-
-
10.02
870.7546
TG 52:5; [M+NH4]+@10.03
TG 52:5
ME224117
-
-
10.03
870.7546
TG 56:8; [M+NH4]+@10.04
TG 56:8
ME224176
-
-
10.04
920.7702
TG 46:1; [M+NH4]+@10.05
TG 46:1
ME224063
-
-
10.05
794.7233
TG 49:3; [M+NH4]+@10.05
TG 49:3
ME224082
-
-
10.05
832.739
TG 53:2; [M+NH4]+@10.05
TG 53:2
ME224126
-
-
10.05
890.8172
TG 56:8; [M+NH4]+@10.05
TG 56:8
ME224177
-
-
10.05
920.7702
TG 60:11; [M+NH4]+@10.05
TG 60:11
ME224203
-
-
10.05
970.7859
TG 48:2; [M+NH4]+@10.08
TG 48:2
ME224072
-
-
10.08
820.739
TG 54:6; [M+NH4]+@10.09
TG 54:6
ME224149
-
-
10.09
896.7702
lysoPC 20:5; [M+H]+@1.01
LPC 20:5
ME224240
11757087
-
1.01
542.3246
TG 46:1; [M+NH4]+@10.11
TG 46:1
ME224064
-
-
10.11
794.7233
TG 55:7; [M+NH4]+@10.11
TG 55:7
ME224160
-
-
10.11
908.7702
TG 50:3; [M+NH4]+@10.12
TG 50:3
ME224089
-
-
10.12
846.7546
TG 51:1; [M+NH4]+@10.14
TG 51:1
ME224095
-
-
10.14
864.8015
TG 51:4; [M+NH4]+@10.14
TG 51:4
ME224104
-
-
10.14
858.7546
TG 48:2; [M+NH4]+@10.15
TG 48:2
ME224073
-
-
10.15
820.739
TG 58:9; [M+NH4]+@10.15
TG 58:9
ME224200
-
-
10.15
946.7859
TG 58:9; [M+NH4]+@10.16
TG 58:9
ME224201
-
-
10.16
946.7859
TG 50:3; [M+NH4]+@10.18
TG 50:3
ME224090
-
-
10.18
846.7546
TG 53:5; [M+NH4]+@10.18
TG 53:5
ME224133
-
-
10.18
884.7702
lysoPC 20:5; [M+H]+@1.02
LPC 20:5
ME224241
11757087
-
1.02
542.3246
TG 52:4; [M+NH4]+@10.20
TG 52:4
ME224113
-
-
10.2
872.7702
TG 53:5; [M+NH4]+@10.20
TG 53:5
ME224134
-
-
10.2
884.7702
TG 56:7; [M+NH4]+@10.22
TG 56:7
ME224174
-
-
10.22
922.7859
TG 52:4; [M+NH4]+@10.23
TG 52:4
ME224114
-
-
10.23
872.7702
TG 56:7; [M+NH4]+@10.24
TG 56:7
ME224175
-
-
10.24
922.7859
TG 60:10; [M+NH4]+@10.24
TG 60:10
ME224202
-
-
10.24
972.8015
TG 54:5; [M+NH4]+@10.26
TG 54:5
ME224146
-
-
10.26
898.7859
TG 49:2; [M+NH4]+@10.28
TG 49:2
ME224080
-
-
10.28
834.7546
TG 49:2; [M+NH4]+@10.29
TG 49:2
ME224081
-
-
10.29
834.7546
TG 54:5; [M+NH4]+@10.29
TG 54:5
ME224147
-
-
10.29
898.7859
TG 55:6; [M+NH4]+@10.29
TG 55:6
ME224159
-
-
10.29
910.7859
TG 58:8; [M+NH4]+@10.29
TG 58:8
ME224198
-
-
10.29
948.8015
lysoPC 14:0; [M+H]+@1.03
LPC 14:0
ME224212
-
-
1.03
468.309
TG 48:1; [M+NH4]+@10.32
TG 48:1
ME224070
-
-
10.32
822.7546
TG 51:3; [M+NH4]+@10.33
TG 51:3
ME224101
-
-
10.33
860.7702
TG 46:0; [M+NH4]+@10.34
TG 46:0
ME224061
-
-
10.34
796.739
TG 58:8; [M+NH4]+@10.34
TG 58:8
ME224199
-
-
10.34
948.8015
TG 46:0; [M+NH4]+@10.35
TG 46:0
ME224062
-
-
10.35
796.739
TG 50:2; [M+NH4]+@10.35
TG 50:2
ME224087
-
-
10.35
848.7702
TG 48:1; [M+NH4]+@10.36
TG 48:1
ME224071
-
-
10.36
822.7546
TG 51:3; [M+NH4]+@10.36
TG 51:3
ME224102
-
-
10.36
860.7702
TG 53:4; [M+NH4]+@10.37
TG 53:4
ME224131
-
-
10.37
886.7859
TG 60:9; [M+NH4]+@10.37
TG 60:9
ME224207
-
-
10.37
974.8172
TG 50:2; [M+NH4]+@10.39
TG 50:2
ME224088
-
-
10.39
848.7702
TG 57:7; [M+NH4]+@10.39
TG 57:7
ME224180
-
-
10.39
936.8015
TG 52:3; [M+NH4]+@10.40
TG 52:3
ME224111
-
-
10.4
874.7859
TG 53:1; [M+NH4]+@10.40
TG 53:1
ME224123
-
-
10.4
892.8328
TG 53:4; [M+NH4]+@10.40
TG 53:4
ME224132
-
-
10.4
886.7859
TG 56:6; [M+NH4]+@10.40
TG 56:6
ME224172
-
-
10.4
924.8015
CE(20:5); [M+NH4]+@10.41
CE 20:5
ME223798
10372299
-
10.41
688.6032
TG 52:3; [M+NH4]+@10.43
TG 52:3
ME224112
-
-
10.43
874.7859
TG 56:6; [M+NH4]+@10.43
TG 56:6
ME224173
-
-
10.43
924.8015
CE(20:5); [M+NH4]+@10.45
CE 20:5
ME223799
10372299
-
10.45
688.6032
TG 58:7; [M+NH4]+@10.45
TG 58:7
ME224196
-
-
10.45
950.8172
TG 54:4; [M+NH4]+@10.46
TG 54:4
ME224144
-
-
10.46
900.8015
TG 55:5; [M+NH4]+@10.46
TG 55:5
ME224158
-
-
10.46
912.8015
TG 54:4; [M+NH4]+@10.48
TG 54:4
ME224145
-
-
10.48
900.8015
CE(22:6); [M+NH4]+@10.49
CE 22:6
ME223805
14274978
-
10.49
714.6189
TG 49:1; [M+NH4]+@10.49
TG 49:1
ME224078
-
-
10.49
836.7702
TG 58:7; [M+NH4]+@10.49
TG 58:7
ME224197
-
-
10.49
950.8172
lysoPC 18:3; [M+H]+@1.05
LPC 18:3
ME224227
-
-
1.05
518.3246
CE(18:3); [M+NH4]+@10.51
CE 18:3
ME223789
6436907
-
10.51
664.6032
TG 49:1; [M+NH4]+@10.51
TG 49:1
ME224079
-
-
10.51
836.7702
TG 60:8; [M+NH4]+@10.52
TG 60:8
ME224206
-
-
10.52
976.8328
TG 51:2; [M+NH4]+@10.53
TG 51:2
ME224098
-
-
10.53
862.7859
TG 57:6; [M+NH4]+@10.53
TG 57:6
ME224179
-
-
10.53
938.8172
CE(18:3); [M+NH4]+@10.54
CE 18:3
ME223790
6436907
-
10.54
664.6032
CE(22:6); [M+NH4]+@10.54
CE 22:6
ME223806
14274978
-
10.54
714.6189
TG 51:2; [M+NH4]+@10.55
TG 51:2
ME224099
-
-
10.55
862.7859
TG 53:3; [M+NH4]+@10.56
TG 53:3
ME224129
-
-
10.56
888.8015
TG 50:1; [M+NH4]+@10.57
TG 50:1
ME224085
-
-
10.57
850.7859
CE(20:4); [M+NH4]+@10.58
CE 20:4
ME223796
6479222
-
10.58
690.6189
TG 48:0; [M+NH4]+@10.58
TG 48:0
ME224068
-
-
10.58
824.7702
TG 56:5; [M+NH4]+@10.58
TG 56:5
ME224170
-
-
10.58
926.8172
TG 50:1; [M+NH4]+@10.59
TG 50:1
ME224086
-
-
10.59
850.7859
TG 52:2; [M+NH4]+@10.59
TG 52:2
ME224109
-
-
10.59
876.8015
TG 53:3; [M+NH4]+@10.59
TG 53:3
ME224130
-
-
10.59
888.8015
lysoPC 18:3; [M+H]+@1.06
LPC 18:3
ME224228
-
-
1.06
518.3246
TG 48:0; [M+NH4]+@10.60
TG 48:0
ME224069
-
-
10.6
824.7702
TG 56:5; [M+NH4]+@10.60
TG 56:5
ME224171
-
-
10.6
926.8172
TG 55:4; [M+NH4]+@10.61
TG 55:4
ME224157
-
-
10.61
914.8172
TG 58:6; [M+NH4]+@10.62
TG 58:6
ME224194
-
-
10.62
952.8328
TG 52:2; [M+NH4]+@10.63
TG 52:2
ME224110
-
-
10.63
876.8015
CE(20:4); [M+NH4]+@10.65
CE 20:4
ME223797
6479222
-
10.65
690.6189
TG 58:6; [M+NH4]+@10.65
TG 58:6
ME224195
-
-
10.65
952.8328
TG 54:3; [M+NH4]+@10.67
TG 54:3
ME224142
-
-
10.67
902.8172
CE(16:1); [M+NH4]+@10.68
CE 16:1
ME223780
-
-
10.68
640.6032
TG 49:0; [M+NH4]+@10.69
TG 49:0
ME224076
-
-
10.69
838.7859
CE(18:2); [M+NH4]+@10.70
CE 18:2
ME223787
5287939
-
10.7
666.6189
TG 54:3; [M+NH4]+@10.70
TG 54:3
ME224143
-
-
10.7
902.8172
CE(22:5); [M+NH4]+@10.71
CE 22:5
ME223803
42608400
-
10.71
716.6345
TG 51:1; [M+NH4]+@10.71
TG 51:1
ME224096
-
-
10.71
864.8015
TG 49:0; [M+NH4]+@10.72
TG 49:0
ME224077
-
-
10.72
838.7859
TG 56:4; [M+NH4]+@10.73
TG 56:4
ME224168
-
-
10.73
928.8328
CE(22:5); [M+NH4]+@10.75
CE 22:5
ME223804
42608400
-
10.75
716.6345
TG 51:1; [M+NH4]+@10.75
TG 51:1
ME224097
-
-
10.75
864.8015
TG 53:2; [M+NH4]+@10.75
TG 53:2
ME224127
-
-
10.75
890.8172
TG 56:4; [M+NH4]+@10.76
TG 56:4
ME224169
-
-
10.76
928.8328
CE(20:3); [M+NH4]+@10.77
CE 20:3
ME223794
14274976
-
10.77
692.6345
TG 55:3; [M+NH4]+@10.78
TG 55:3
ME224156
-
-
10.78
916.8328
CE(18:2); [M+NH4]+@10.79
CE 18:2
ME223788
5287939
-
10.79
666.6189
TG 53:2; [M+NH4]+@10.79
TG 53:2
ME224128
-
-
10.79
890.8172
TG 58:5; [M+NH4]+@10.81
TG 58:5
ME224192
-
-
10.81
954.8484
CE(20:3); [M+NH4]+@10.82
CE 20:3
ME223795
14274976
-
10.82
692.6345
TG 50:0; [M+NH4]+@10.82
TG 50:0
ME224083
-
-
10.82
852.8015
TG 60:6; [M+NH4]+@10.83
TG 60:6
ME224205
-
-
10.83
980.8641
TG 50:0; [M+NH4]+@10.84
TG 50:0
ME224084
-
-
10.84
852.8015
TG 52:1; [M+NH4]+@10.84
TG 52:1
ME224107
-
-
10.84
878.8172
TG 52:1; [M+NH4]+@10.85
TG 52:1
ME224108
-
-
10.85
878.8172
TG 58:5; [M+NH4]+@10.85
TG 58:5
ME224193
-
-
10.85
954.8484
CE(17:1); [M+NH4]+@10.87
CE 17:1
ME223781
24779603
-
10.87
654.6189
TG 54:2; [M+NH4]+@10.87
TG 54:2
ME224140
-
-
10.87
904.8328
CE(22:4); [M+NH4]+@10.88
CE 22:4
ME223801
16061341
-
10.88
718.6502
TG 54:2; [M+NH4]+@10.90
TG 54:2
ME224141
-
-
10.9
904.8328
TG 56:3; [M+NH4]+@10.90
TG 56:3
ME224166
-
-
10.9
930.8484
CE(18:1); [M+NH4]+@10.91
CE 18:1
ME223785
5283632
-
10.91
668.6345
CE(17:1); [M+NH4]+@10.93
CE 17:1
ME223782
24779603
-
10.93
654.6189
CE(22:4); [M+NH4]+@10.93
CE 22:4
ME223802
16061341
-
10.93
718.6502
TG 56:3; [M+NH4]+@10.93
TG 56:3
ME224167
-
-
10.93
930.8484
TG 53:1; [M+NH4]+@10.95
TG 53:1
ME224124
-
-
10.95
892.8328
TG 55:2; [M+NH4]+@10.96
TG 55:2
ME224155
-
-
10.96
918.8484
CE(16:0); [M+NH4]+@10.98
CE 16:0
ME223778
246520
-
10.98
642.6189
TG 53:1; [M+NH4]+@10.98
TG 53:1
ME224125
-
-
10.98
892.8328
TG 58:4; [M+NH4]+@10.99
TG 58:4
ME224191
-
-
10.99
956.8641
CE(16:0); [M+NH4]+@11.03
CE 16:0
ME223779
246520
-
11.03
642.6189
CE(18:1); [M+NH4]+@11.05
CE 18:1
ME223786
5283632
-
11.05
668.6345
TG 52:0; [M+NH4]+@11.05
TG 52:0
ME224105
-
-
11.05
880.8328
TG 56:2; [M+NH4]+@11.06
TG 56:2
ME224164
-
-
11.06
932.8641
CE(20:2); [M+NH4]+@11.07
CE 20:2
ME223793
16061338
-
11.07
694.6502
TG 54:1; [M+NH4]+@11.07
TG 54:1
ME224138
-
-
11.07
906.8484
TG 52:0; [M+NH4]+@11.09
TG 52:0
ME224106
-
-
11.09
880.8328
TG 54:1; [M+NH4]+@11.11
TG 54:1
ME224139
-
-
11.11
906.8484
TG 56:2; [M+NH4]+@11.13
TG 56:2
ME224165
-
-
11.13
932.8641
TG 58:3; [M+NH4]+@11.14
TG 58:3
ME224189
-
-
11.14
958.8797
TG 58:3; [M+NH4]+@11.16
TG 58:3
ME224190
-
-
11.16
958.8797
TG 53:0; [M+NH4]+@11.18
TG 53:0
ME224121
-
-
11.18
894.8484
TG 55:1; [M+NH4]+@11.18
TG 55:1
ME224154
-
-
11.18
920.8641
lysoPE 18:3; [M+H]+@1.12
LPE 18:3
ME224254
-
-
1.12
476.2777
TG 53:0; [M+NH4]+@11.20
TG 53:0
ME224122
-
-
11.2
894.8484
CE(20:1); [M+NH4]+@11.29
CE 20:1
ME223792
16061337
-
11.29
696.6659
TG 54:0; [M+NH4]+@11.30
TG 54:0
ME224136
-
-
11.3
908.8641
TG 56:1; [M+NH4]+@11.32
TG 56:1
ME224162
-
-
11.32
934.8797
TG 54:0; [M+NH4]+@11.33
TG 54:0
ME224137
-
-
11.33
908.8641
TG 56:1; [M+NH4]+@11.35
TG 56:1
ME224163
-
-
11.35
934.8797
TG 58:2; [M+NH4]+@11.35
TG 58:2
ME224187
-
-
11.35
960.8954
TG 58:2; [M+NH4]+@11.36
TG 58:2
ME224188
-
-
11.36
960.8954
CE(18:0); [M+NH4]+@11.37
CE 18:0
ME223783
118246
-
11.37
670.6502
TG 55:0; [M+NH4]+@11.41
TG 55:0
ME224153
-
-
11.41
922.8797
CE(18:0); [M+NH4]+@11.42
CE 18:0
ME223784
118246
-
11.42
670.6502
lysoPC 16:1; [M+H]+@1.15
LPC 16:1
ME224217
-
-
1.15
494.3246
TG 56:0; [M+NH4]+@11.59
TG 56:0
ME224161
-
-
11.59
936.8954
TG 58:1; [M+NH4]+@11.59
TG 58:1
ME224186
-
-
11.59
962.911
lysoPC 16:1; [M+H]+@1.16
LPC 16:1
ME224218
-
-
1.16
494.3246
lysoPC 22:6; [M+H]+@1.18
LPC 22:6
ME224246
10415542
-
1.18
568.3403
TG 58:0; [M+NH4]+@11.86
TG 58:0
ME224181
-
-
11.86
964.9267
lysoPC 15:0; [M+H]+@1.20
LPC 15:0
ME224213
24779458
-
1.2
482.3246
lysoPC 22:6; [M+H]+@1.22
LPC 22:6
ME224247
10415542
-
1.22
568.3403
lysoPE 22:6; [M+H]+@1.22
LPE 22:6
ME224258
-
-
1.22
526.2933
TG 62:1; [M+NH4]+@12.22
TG 62:1
ME224210
-
-
12.22
1018.9736
lysoPC 15:0; [M+H]+@1.24
LPC 15:0
ME224214
24779458
-
1.24
482.3246
lysoPC 18:2; [M+H]+@1.25
LPC 18:2
ME224225
-
-
1.25
520.3403
lysoPE 20:4; [M+H]+@1.26
LPE 20:4
ME224255
-
-
1.26
502.2934
lysoPE 20:4; [M+H]+@1.27
LPE 20:4
ME224256
-
-
1.27
502.2934
PC 21:4; [M+H]+@1.27
PC 21:4
ME223877
-
-
1.27
572.3352
lysoPC 20:4; [M+H]+@1.30
LPC 20:4
ME224238
-
-
1.3
544.3403
lysoPC 20:4; [M+H]+@1.31
LPC 20:4
ME224239
-
-
1.31
544.3403
lysoPE 18:2; [M+H]+@1.32
LPE 18:2
ME224253
-
-
1.32
478.2934
PE 21:4; [M+H]+@1.33
PE 21:4
ME223951
-
-
1.33
530.2883
lysoPC 18:2; [M+H]+@1.37
LPC 18:2
ME224226
-
-
1.37
520.3403
PE 19:2; [M+H]+@1.39
PE 19:2
ME223950
-
-
1.39
506.2883
lysoPC 17:1; [M+H]+@1.42
LPC 17:1
ME224219
-
-
1.42
508.3403
lysoPC 20:3; [M+H]+@1.43
LPC 20:3
ME224236
-
-
1.43
546.356
lysoPC 22:5; [M+H]+@1.44
LPC 22:5
ME224245
-
-
1.44
570.356
lysoPE 22:5; [M+H]+@1.45
LPE 22:5
ME224257
-
-
1.45
528.309
lysoPC 17:1; [M+H]+@1.46
LPC 17:1
ME224220
-
-
1.46
508.3403
lysoPC 20:3; [M+H]+@1.50
LPC 20:3
ME224237
-
-
1.5
546.356
lysoPC 16:0; [M+H]+@1.55
LPC 16:0
ME224215
-
-
1.55
496.3403
lysoPC 16:0; [M+H]+@1.56
LPC 16:0
ME224216
-
-
1.56
496.3403
lysoPC 18:1; [M+H]+@1.65
LPC 18:1
ME224223
-
-
1.65
522.356
lysoPE 16:0; [M+H]+@1.68
LPE 16:0
ME224250
-
-
1.68
454.2934
PC 19:1; [M+H]+@1.78
PC 19:1
ME223875
24778752
-
1.78
550.3509
plasmenyl-PC 18:0; [M+Na]+@1.79
PC P-18:0
ME224259
-
-
1.79
544.3379
lysoPC 18:1; [M+H]+@1.80
LPC 18:1
ME224224
-
-
1.8
522.356
lysoPC 22:4; [M+H]+@1.82
LPC 22:4
ME224244
52924039
-
1.82
572.3716
lysoPE 18:1; [M+H]+@1.82
LPE 18:1
ME224252
-
-
1.82
480.309
PE 23:4; [M+H]+@1.89
PE 23:4
ME223952
-
-
1.89
558.3196
lysoPC 20:2; [M+H]+@1.93
LPC 20:2
ME224235
52924053
-
1.93
548.3716
MG 18:2; [M+NH4]+@2.27
MG 18:2
ME223874
5283469
-
2.27
372.3114
lysoPC 18:0; [M+H]+@2.31
LPC 18:0
ME224221
-
-
2.31
524.3716
PC 20:0; [M+H]+@2.37
PC 20:0
ME223876
-
-
2.37
566.3821
lysoPC 18:0; [M+H]+@2.38
LPC 18:0
ME224222
-
-
2.38
524.3716
lysoPE 18:0; [M+H]+@2.48
LPE 18:0
ME224251
-
-
2.48
482.3246
lysoPC 20:1; [M+H]+@2.51
LPC 20:1
ME224233
-
-
2.51
550.3873
lysoPC 20:1; [M+H]+@2.54
LPC 20:1
ME224234
-
-
2.54
550.3873
MG 16:0; [M+NH4]+@2.71
MG 16:0
ME223871
-
-
2.71
348.3114
lysoPC 19:0; [M+H]+@2.81
LPC 19:0
ME224229
24779472
-
2.81
538.3873
lysoPC 19:0; [M+H]+@2.83
LPC 19:0
ME224230
24779472
-
2.83
538.3873
MG 18:1; [M+NH4]+@2.92
MG 18:1
ME223873
-
-
2.92
374.327
MG 17:0; [M+Li]+@3.14
MG 17:0
ME223872
107036
-
3.14
351.3087
lysoPC 20:0; [M+H]+@3.25
LPC 20:0
ME224231
24779473
-
3.25
552.4029
lysoPC 20:0; [M+H]+@3.33
LPC 20:0
ME224232
24779473
-
3.33
552.4029
SM 28:1; [M]+@3.57
SM 18:1;O2/28:1
ME223969
-
-
3.57
619.4815
lysoPC 22:0; [M+H]+@4.21
LPC 22:0
ME224242
24779479
-
4.21
580.4342
lysoPC 22:0; [M+H]+@4.29
LPC 22:0
ME224243
24779479
-
4.29
580.4342
SM 30:1; [M]+@4.29
SM 30:1;O2
ME223971
-
-
4.29
647.5128
lysoPC 24:1; [M+H]+@4.30
LPC 24:1
ME224249
53480477
-
4.3
606.4498
SM 30:1; [M]+@4.33
SM 30:1;O2
ME223972
-
-
4.33
647.5128
SM 32:2; [M]+@4.48
SM 32:2;O2
ME223978
-
-
4.48
673.5284
SM 30:0; [M]+@4.63
SM 30:0;O2
ME223970
46891775
-
4.63
649.5284
PC 28:1; [M+H]+@4.71
PC 28:1
ME223878
-
-
4.71
676.4917
SM 31:1; [M]+@4.72
SM 31:1;O2
ME223973
-
-
4.72
661.5284
SM 31:1; [M]+@4.74
SM 31:1;O2
ME223974
-
-
4.74
661.5284
SM 33:2; [M]+@4.94
SM 33:2;O2
ME223984
-
-
4.94
687.5441
SM 33:2; [M]+@4.96
SM 33:2;O2
ME223985
-
-
4.96
687.5441
SM 32:1; [M]+@5.04
SM 32:1;O2
ME223976
11433862
-
5.04
675.5441
SM 32:1; [M]+@5.08
SM 32:1;O2
ME223977
11433862
-
5.08
675.5441
PC 32:3; [M+H]+@5.09
PC 32:3
ME223885
-
-
5.09
728.523
PC 34:2; [M+H]+@5.12
PC 34:2
ME223891
-
-
5.12
758.57
lysoPC 24:0; [M+H]+@5.19
LPC 24:0
ME224248
24779481
-
5.19
608.4655
PC 32:3; [M+H]+@5.21
PC 32:3
ME223886
-
-
5.21
728.523
PC 34:5; [M+H]+@5.21
PC 34:5
ME223896
-
-
5.21
752.523
SM 34:2; [M]+@5.23
SM 34:2;O2
ME223989
-
-
5.23
701.5597
SM 38:5; [M]+@5.24
SM 38:5;O2
ME224011
-
-
5.24
751.5754
SM 34:2; [M]+@5.27
SM 34:2;O2
ME223990
-
-
5.27
701.5597
SM 33:1; [M]+@5.34
SM 33:1;O2
ME223982
52931139
-
5.34
689.5597
PC 36:6; [M+H]+@5.35
PC 36:6
ME223912
-
-
5.35
778.5387
PC 30:1; [M+H]+@5.37
PC 30:1
ME223881
-
-
5.37
704.523
PC 34:4; [M+H]+@5.40
PC 34:4
ME223894
-
-
5.4
754.5387
SM 32:0; [M]+@5.42
SM 32:0;O2
ME223975
44260138
-
5.42
677.5597
PC 40:9; [M+H]+@5.43
PC 40:9
ME223937
-
-
5.43
828.5543
SM 33:1; [M]+@5.44
SM 33:1;O2
ME223983
52931139
-
5.44
689.5597
PC 38:9; [M+H]+@5.46
PC 38:9
ME223924
-
-
5.46
800.523
PC 35:5; [M+H]+@5.47
PC 35:5
ME223903
-
-
5.47
766.5387
PC 36:6; [M+H]+@5.47
PC 36:6
ME223913
-
-
5.47
778.5387
PC 36:7; [M+H]+@5.47
PC 36:7
ME223914
-
-
5.47
776.523
SM 33:1; [M+Na]+@5.47
SM 33:1;O2
ME223981
52931139
-
5.47
711.5417
PC 32:2; [M+H]+@5.50
PC 32:2
ME223884
-
-
5.5
730.5387
PC 35:5; [M+H]+@5.54
PC 35:5
ME223904
-
-
5.54
766.5387
SM 35:0; [M]+@5.58
SM 35:0;O2
ME223991
-
-
5.58
719.6067
PE 36:6; [M+H]+@5.61
PE 36:6
ME223962
-
-
5.61
736.4917
PC 33:3; [M+H]+@5.62
PC 33:3
ME223889
-
-
5.62
742.5387
PC 40:10; [M+H]+@5.62
PC 40:10
ME223930
-
-
5.62
826.5387
SM 35:2; [M]+@5.65
SM 35:2;O2
ME223992
-
-
5.65
715.5754
SM 38:4; [M]+@5.69
SM 38:4;O2
ME224010
-
-
5.69
753.5911
PC 36:5; [M+H]+@5.70
PC 36:5
ME223911
-
-
5.7
780.5543
PC 42:10; [M+H]+@5.72
PC 42:10
ME223939
-
-
5.72
854.57
PC 34:3; [M+H]+@5.73
PC 34:3
ME223893
-
-
5.73
756.5543
PE 32:2; [M+H]+@5.73
PE 32:2
ME223953
-
-
5.73
688.4917
SM 33:0; [M]+@5.73
SM 33:0;O2
ME223979
-
-
5.73
691.5754
PC 40:8; [M+H]+@5.75
PC 40:8
ME223936
-
-
5.75
830.57
PC 42:11; [M+H]+@5.75
PC 42:11
ME223940
-
-
5.75
852.5543
SM 34:1; [M]+@5.75
SM 34:1;O2
ME223987
-
-
5.75
703.5754
PC 30:0; [M+H]+@5.76
PC 30:0
ME223879
-
-
5.76
706.5387
PC 38:8; [M+H]+@5.77
PC 38:8
ME223923
-
-
5.77
802.5387
PC 35:4; [M+H]+@5.78
PC 35:4
ME223901
-
-
5.78
768.5543
SM 33:0; [M]+@5.79
SM 33:0;O2
ME223980
-
-
5.79
691.5754
PC 37:6; [M+H]+@5.80
PC 37:6
ME223915
-
-
5.8
792.5543
PC 35:4; [M+H]+@5.81
PC 35:4
ME223902
-
-
5.81
768.5543
SM 34:1; [M]+@5.81
SM 34:1;O2
ME223988
-
-
5.81
703.5754
PC 33:2; [M+H]+@5.85
PC 33:2
ME223888
-
-
5.85
744.5543
PC 30:0; [M+H]+@5.87
PC 30:0
ME223880
-
-
5.87
706.5387
SM 40:5; [M]+@5.93
SM 40:5;O2
ME224023
-
-
5.93
779.6067
SM 36:2; [M]+@5.94
SM 36:2;O2
ME223997
-
-
5.94
729.5911
PC 36:4; [M+H]+@5.97
PC 36:4
ME223909
-
-
5.97
782.57
PC 37:7; [M+H]+@5.97
PC 37:7
ME223916
-
-
5.97
790.5387
SM 36:2; [M]+@5.97
SM 36:2;O2
ME223998
-
-
5.97
729.5911
PC 35:3; [M+H]+@6.01
PC 35:3
ME223899
-
-
6.01
770.57
PC 42:9; [M+H]+@6.02
PC 42:9
ME223948
-
-
6.02
856.5856
PC 39:7; [M+H]+@6.03
PC 39:7
ME223929
-
-
6.03
818.57
SM 34:0; [M]+@6.04
SM 34:0;O2
ME223986
9939965
-
6.04
705.5911
PC 38:6; [M+H]+@6.06
PC 38:6
ME223922
-
-
6.06
806.57
PC 31:0; [M+H]+@6.13
PC 31:0
ME223882
-
-
6.13
720.5543
PC 34:4; [M+H]+@6.14
PC 34:4
ME223895
-
-
6.14
754.5387
PC 34:2; [M+H]+@6.16
PC 34:2
ME223892
-
-
6.16
758.57
PC 36:4; [M+H]+@6.18
PC 36:4
ME223910
-
-
6.18
782.57
SM 38:0; [M]+@6.20
SM 38:0;O2
ME224004
44260131
-
6.2
761.6536
PC 39:6; [M+H]+@6.23
PC 39:6
ME223928
-
-
6.23
820.5856
SM 41:5; [M]+@6.27
SM 41:5;O2
ME224029
-
-
6.27
793.6224
PC 38:5; [M+H]+@6.30
PC 38:5
ME223921
-
-
6.3
808.5856
plasmenyl-PE 36:5; [M+H]+@6.30
PE P-36:5
ME224275
-
-
6.3
722.5125
SM 40:4; [M]+@6.30
SM 40:4;O2
ME224022
-
-
6.3
781.6224
PC 36:3; [M+H]+@6.31
PC 36:3
ME223908
-
-
6.31
784.5856
SM 37:2; [M]+@6.33
SM 37:2;O2
ME224002
-
-
6.33
743.6067
PC 39:5; [M+H]+@6.35
PC 39:5
ME223927
-
-
6.35
822.6013
PE 36:4; [M+H]+@6.35
PE 36:4
ME223961
-
-
6.35
740.523
PC 33:1; [M+H]+@6.36
PC 33:1
ME223887
-
-
6.36
746.57
PE 34:2; [M+H]+@6.38
PE 34:2
ME223955
-
-
6.38
716.523
SM 36:1; [M]+@6.43
SM 36:1;O2
ME223995
44260139
-
6.43
731.6067
SM 37:2; [M]+@6.43
SM 37:2;O2
ME224003
-
-
6.43
743.6067
PC 35:2; [M+H]+@6.45
PC 35:2
ME223898
-
-
6.45
772.5856
SM 36:1; [M]+@6.45
SM 36:1;O2
ME223996
44260139
-
6.45
731.6067
DG 30:2; [M+NH4]+@6.46
DG 30:2
ME223811
-
-
6.46
554.4782
PC 32:0; [M+H]+@6.48
PC 32:0
ME223883
-
-
6.48
734.57
SM 42:5; [M]+@6.49
SM 42:5;O2
ME224037
-
-
6.49
807.638
SM 38:2; [M]+@6.53
SM 38:2;O2
ME224008
-
-
6.53
757.6224
SM 42:5; [M]+@6.53
SM 42:5;O2
ME224038
-
-
6.53
807.638
plasmenyl-PE 32:1; [M+H]+@6.57
PE P-32:1
ME224267
-
-
6.57
674.5125
SM 41:5; [M]+@6.60
SM 41:5;O2
ME224030
-
-
6.6
793.6224
PC 34:1; [M+H]+@6.61
PC 34:1
ME223890
-
-
6.61
760.5856
plasmenyl-PE 36:4; [M+H]+@6.63
PE P-36:4
ME224274
-
-
6.63
724.5281
PE 37:4; [M+H]+@6.64
PE 37:4
ME223963
-
-
6.64
754.5387
PC 40:6; [M+H]+@6.65
PC 40:6
ME223935
-
-
6.65
834.6013
SM 41:4; [M]+@6.65
SM 41:4;O2
ME224028
-
-
6.65
795.638
SM 38:2; [M]+@6.66
SM 38:2;O2
ME224009
-
-
6.66
757.6224
plasmenyl-PE 34:2; [M+H]+@6.67
PE P-34:2
ME224269
-
-
6.67
700.5281
PE 35:2; [M+H]+@6.68
PE 35:2
ME223956
-
-
6.68
730.5387
plasmenyl-PC 36:3; [M+Na]+@6.70
PC P-36:3
ME224261
-
-
6.7
790.5727
SM 37:1; [M]+@6.70
SM 37:1;O2
ME224000
-
-
6.7
745.6224
plasmenyl-PE 34:2; [M+H]+@6.73
PE P-34:2
ME224270
-
-
6.73
700.5281
SM 36:0; [M]+@6.74
SM 36:0;O2
ME223993
52931167
-
6.74
733.6224
SM 38:0; [M]+@6.74
SM 38:0;O2
ME224005
44260131
-
6.74
761.6536
PC 38:4; [M+H]+@6.75
PC 38:4
ME223920
-
-
6.75
810.6013
SM 36:0; [M]+@6.78
SM 36:0;O2
ME223994
52931167
-
6.78
733.6224
PC 36:2; [M+H]+@6.81
PC 36:2
ME223907
-
-
6.81
786.6013
PE 34:1; [M+H]+@6.81
PE 34:1
ME223954
-
-
6.81
718.5387
PC 40:5; [M+H]+@6.82
PC 40:5
ME223934
-
-
6.82
836.617
SM 37:1; [M]+@6.85
SM 37:1;O2
ME224001
-
-
6.85
745.6224
SM 42:4; [M]+@6.85
SM 42:4;O2
ME224035
-
-
6.85
809.6536
SM 42:4; [M]+@6.86
SM 42:4;O2
ME224036
-
-
6.86
809.6536
PE 40:6; [M+H]+@6.88
PE 40:6
ME223968
-
-
6.88
792.5543
DG 34:4; [M+NH4]+@6.90
DG 34:4
ME223831
-
-
6.9
606.5094
PC 42:7; [M+H]+@6.90
PC 42:7
ME223946
-
-
6.9
860.617
DG 30:1; [M+NH4]+@6.91
DG 30:1
ME223809
-
-
6.91
556.4938
DG 30:1; [M+NH4]+@6.93
DG 30:1
ME223810
-
-
6.93
556.4938
DG 38:7; [M+NH4]+@6.93
DG 38:7
ME223862
-
-
6.93
656.5251
PE 36:2; [M+H]+@6.96
PE 36:2
ME223959
-
-
6.96
744.5543
PE 38:4; [M+H]+@6.98
PE 38:4
ME223964
-
-
6.98
768.5543
DG 36:5; [M+NH4]+@6.99
DG 36:5
ME223848
-
-
6.99
632.5251
PC 38:3; [M+H]+@7.00
PC 38:3
ME223919
-
-
7
812.617
DG 36:5; [M+NH4]+@7.01
DG 36:5
ME223849
-
-
7.01
632.5251
SM 39:2; [M]+@7.01
SM 39:2;O2
ME224014
-
-
7.01
771.638
PE 36:2; [M+H]+@7.03
PE 36:2
ME223960
-
-
7.03
744.5543
DG 32:2; [M+NH4]+@7.06
DG 32:2
ME223818
-
-
7.06
582.5094
SM 39:2; [M]+@7.06
SM 39:2;O2
ME224015
-
-
7.06
771.638
DG 32:2; [M+NH4]+@7.09
DG 32:2
ME223819
-
-
7.09
582.5094
PC 39:4; [M+H]+@7.10
PC 39:4
ME223926
-
-
7.1
824.617
plasmenyl-PE 34:1; [M+H]+@7.11
PE P-34:1
ME224268
-
-
7.11
702.5438
plasmenyl-PC 34:1; [M+Na]+@7.12
PC P-34:1
ME224260
-
-
7.12
766.5727
SM 38:1; [M]+@7.12
SM 38:1;O2
ME224006
-
-
7.12
759.638
plasmenyl-PC 38:3; [M+Na]+@7.13
PC P-38:3
ME224263
-
-
7.13
818.604
DG 34:3; [M+NH4]+@7.17
DG 34:3
ME223829
-
-
7.17
608.5251
DG 40:8; [M+NH4]+@7.18
DG 40:8
ME223870
-
-
7.18
682.5407
DG 33:2; [M+NH4]+@7.19
DG 33:2
ME223824
-
-
7.19
596.5251
SM 37:0; [M]+@7.19
SM 37:0;O2
ME223999
-
-
7.19
747.638
SM 38:1; [M]+@7.19
SM 38:1;O2
ME224007
-
-
7.19
759.638
SM 40:2; [M]+@7.20
SM 40:2;O2
ME224020
-
-
7.2
785.6536
DG 34:3; [M+NH4]+@7.22
DG 34:3
ME223830
-
-
7.22
608.5251
PC 35:3; [M+H]+@7.22
PC 35:3
ME223900
-
-
7.22
770.57
PC 36:1; [M+H]+@7.22
PC 36:1
ME223906
-
-
7.22
788.617
PC 42:8; [M+H]+@7.23
PC 42:8
ME223947
-
-
7.23
858.6013
PC 42:6; [M+H]+@7.24
PC 42:6
ME223945
-
-
7.24
862.6326
PE 40:5; [M+H]+@7.24
PE 40:5
ME223967
-
-
7.24
794.57
plasmenyl-PE 38:4; [M+H]+@7.25
PE P-38:4
ME224279
-
-
7.25
752.5594
plasmenyl-PE 36:2; [M+H]+@7.26
PE P-36:2
ME224272
-
-
7.26
728.5594
DG 38:6; [M+NH4]+@7.27
DG 38:6
ME223860
-
-
7.27
658.5407
PC 40:4; [M+H]+@7.27
PC 40:4
ME223933
-
-
7.27
838.6326
SM 40:2; [M]+@7.28
SM 40:2;O2
ME224021
-
-
7.28
785.6536
PC 38:2; [M+H]+@7.31
PC 38:2
ME223918
-
-
7.31
814.6326
plasmenyl-PE 36:2; [M+H]+@7.33
PE P-36:2
ME224273
-
-
7.33
728.5594
DG 36:4; [M+NH4]+@7.38
DG 36:4
ME223846
-
-
7.38
634.5407
DG 38:6; [M+NH4]+@7.38
DG 38:6
ME223861
-
-
7.38
658.5407
PE 40:4; [M+H]+@7.38
PE 40:4
ME223966
-
-
7.38
796.5856
DG 30:0; [M+NH4]+@7.39
DG 30:0
ME223807
-
-
7.39
558.5094
PE 36:1; [M+H]+@7.39
PE 36:1
ME223958
-
-
7.39
746.57
DG 30:0; [M+NH4]+@7.40
DG 30:0
ME223808
-
-
7.4
558.5094
DG 36:4; [M+NH4]+@7.40
DG 36:4
ME223847
-
-
7.4
634.5407
SM 39:1; [M]+@7.40
SM 39:1;O2
ME224012
-
-
7.4
773.6536
SM 43:5; [M]+@7.42
SM 43:5;O2
ME224044
-
-
7.42
821.6536
SM 41:2; [M]+@7.43
SM 41:2;O2
ME224026
-
-
7.43
799.6693
PC 39:3; [M+H]+@7.45
PC 39:3
ME223925
-
-
7.45
826.6326
PC 42:5; [M+H]+@7.46
PC 42:5
ME223943
-
-
7.46
864.6482
SM 43:4; [M]+@7.47
SM 43:4;O2
ME224043
-
-
7.47
823.6693
DG 32:1; [M+NH4]+@7.48
DG 32:1
ME223816
-
-
7.48
584.5251
plasmenyl-PE 38:3; [M+H]+@7.49
PE P-38:3
ME224278
-
-
7.49
754.5751
DG 32:1; [M+NH4]+@7.50
DG 32:1
ME223817
-
-
7.5
584.5251
PC 35:0; [M+H]+@7.50
PC 35:0
ME223897
-
-
7.5
776.617
DG 35:3; [M+NH4]+@7.51
DG 35:3
ME223837
-
-
7.51
622.5407
SM 39:1; [M]+@7.54
SM 39:1;O2
ME224013
-
-
7.54
773.6536
DG 40:7; [M+NH4]+@7.55
DG 40:7
ME223868
-
-
7.55
684.5564
DG 34:2; [M+NH4]+@7.56
DG 34:2
ME223827
-
-
7.56
610.5407
PC 42:5; [M+H]+@7.57
PC 42:5
ME223944
-
-
7.57
864.6482
DG 31:0; [M+NH4]+@7.58
DG 31:0
ME223812
-
-
7.58
572.5251
DG 40:7; [M+NH4]+@7.60
DG 40:7
ME223869
-
-
7.6
684.5564
DG 34:2; [M+NH4]+@7.61
DG 34:2
ME223828
-
-
7.61
610.5407
DG 38:5; [M+NH4]+@7.61
DG 38:5
ME223858
-
-
7.61
660.5564
SM 41:2; [M]+@7.62
SM 41:2;O2
ME224027
-
-
7.62
799.6693
DG 31:0; [M+NH4]+@7.63
DG 31:0
ME223813
-
-
7.63
572.5251
SM 40:1; [M]+@7.65
SM 40:1;O2
ME224018
-
-
7.65
787.6693
DG 36:3; [M+NH4]+@7.66
DG 36:3
ME223844
-
-
7.66
636.5564
DG 33:1; [M+NH4]+@7.67
DG 33:1
ME223822
-
-
7.67
598.5407
plasmenyl-PE 40:4; [M+H]+@7.67
PE P-40:4
ME224280
-
-
7.67
780.5907
plasmenyl-PE 36:1; [M+H]+@7.68
PE P-36:1
ME224271
-
-
7.68
730.5751
DG 38:5; [M+NH4]+@7.69
DG 38:5
ME223859
-
-
7.69
660.5564
SM 42:2; [M]+@7.70
SM 42:2;O2
ME224033
-
-
7.7
813.6849
DG 36:3; [M+NH4]+@7.71
DG 36:3
ME223845
-
-
7.71
636.5564
DG 40:6; [M+NH4]+@7.72
DG 40:6
ME223866
-
-
7.72
686.572
PC 41:4; [M+H]+@7.72
PC 41:4
ME223938
-
-
7.72
852.6482
SM 40:1; [M]+@7.73
SM 40:1;O2
ME224019
-
-
7.73
787.6693
DG 33:1; [M+NH4]+@7.76
DG 33:1
ME223823
-
-
7.76
598.5407
DG 40:6; [M+NH4]+@7.77
DG 40:6
ME223867
-
-
7.77
686.572
SM 42:2; [M]+@7.78
SM 42:2;O2
ME224034
-
-
7.78
813.6849
plasmenyl-PC 40:3; [M+Na]+@7.80
PC P-40:3
ME224264
-
-
7.8
846.6353
PE 36:0; [M+H]+@7.82
PE 36:0
ME223957
-
-
7.82
748.5856
plasmenyl-PE 38:2; [M+H]+@7.82
PE P-38:2
ME224277
-
-
7.82
756.5907
DG 35:2; [M+NH4]+@7.86
DG 35:2
ME223835
-
-
7.86
624.5564
SM 43:2; [M]+@7.86
SM 43:2;O2
ME224041
-
-
7.86
827.7006
DG 35:2; [M+NH4]+@7.87
DG 35:2
ME223836
-
-
7.87
624.5564
DG 32:0; [M+NH4]+@7.89
DG 32:0
ME223814
-
-
7.89
586.5407
SM 40:0; [M]+@7.89
SM 40:0;O2
ME224016
44260132
-
7.89
789.6849
DG 32:0; [M+NH4]+@7.90
DG 32:0
ME223815
-
-
7.9
586.5407
DG 38:4; [M+NH4]+@7.90
DG 38:4
ME223856
-
-
7.9
662.572
PC 36:0; [M+H]+@7.90
PC 36:0
ME223905
-
-
7.9
790.6326
SM 41:1; [M]+@7.90
SM 41:1;O2
ME224024
-
-
7.9
801.6849
PC 38:1; [M+H]+@7.95
PC 38:1
ME223917
-
-
7.95
816.6482
plasmenyl-PC 38:0; [M+Na]+@7.96
PC P-38:0
ME224262
-
-
7.96
824.6509
SM 43:2; [M]+@7.97
SM 43:2;O2
ME224042
-
-
7.97
827.7006
DG 36:2; [M+NH4]+@8.03
DG 36:2
ME223842
-
-
8.03
638.572
plasmenyl-PC 42:4; [M+Na]+@8.03
PC P-42:4
ME224265
-
-
8.03
872.6509
SM 40:0; [M]+@8.03
SM 40:0;O2
ME224017
44260132
-
8.03
789.6849
DG 38:4; [M+NH4]+@8.04
DG 38:4
ME223857
-
-
8.04
662.572
PC 42:4; [M+H]+@8.05
PC 42:4
ME223942
-
-
8.05
866.6639
DG 40:5; [M+NH4]+@8.06
DG 40:5
ME223864
-
-
8.06
688.5877
SM 41:1; [M]+@8.06
SM 41:1;O2
ME224025
-
-
8.06
801.6849
DG 36:2; [M+NH4]+@8.07
DG 36:2
ME223843
-
-
8.07
638.572
DG 40:5; [M+NH4]+@8.08
DG 40:5
ME223865
-
-
8.08
688.5877
DG 33:0; [M+NH4]+@8.09
DG 33:0
ME223820
-
-
8.09
600.5564
DG 33:0; [M+NH4]+@8.12
DG 33:0
ME223821
-
-
8.12
600.5564
PC 40:2; [M+H]+@8.12
PC 40:2
ME223932
-
-
8.12
842.6639
SM 42:1; [M]+@8.16
SM 42:1;O2
ME224031
44260133
-
8.16
815.7006
plasmenyl-PE 38:1; [M+H]+@8.18
PE P-38:1
ME224276
-
-
8.18
758.6063
DG 35:1; [M+NH4]+@8.21
DG 35:1
ME223833
-
-
8.21
626.572
DG 38:3; [M+NH4]+@8.22
DG 38:3
ME223854
-
-
8.22
664.5877
SM 44:2; [M]+@8.23
SM 44:2;O2
ME224047
-
-
8.23
841.7163
DG 35:1; [M+NH4]+@8.25
DG 35:1
ME223834
-
-
8.25
626.572
SM 42:1; [M]+@8.33
SM 42:1;O2
ME224032
44260133
-
8.33
815.7006
SM 44:2; [M]+@8.33
SM 44:2;O2
ME224048
-
-
8.33
841.7163
SM 43:1; [M]+@8.34
SM 43:1;O2
ME224039
-
-
8.34
829.7163
DG 38:3; [M+NH4]+@8.35
DG 38:3
ME223855
-
-
8.35
664.5877
PE 40:1; [M+H]+@8.37
PE 40:1
ME223965
-
-
8.37
802.6326
DG 34:0; [M+NH4]+@8.39
DG 34:0
ME223825
-
-
8.39
614.572
DG 34:0; [M+NH4]+@8.42
DG 34:0
ME223826
-
-
8.42
614.572
DG 36:1; [M+NH4]+@8.46
DG 36:1
ME223840
-
-
8.46
640.5877
DG 40:4; [M+NH4]+@8.49
DG 40:4
ME223863
-
-
8.49
690.6033
DG 36:1; [M+NH4]+@8.50
DG 36:1
ME223841
-
-
8.5
640.5877
plasmenyl-PC 44:4; [M+Na]+@8.50
PC P-44:4
ME224266
-
-
8.5
900.6822
PC 40:1; [M+H]+@8.54
PC 40:1
ME223931
-
-
8.54
844.6795
SM 43:1; [M]+@8.54
SM 43:1;O2
ME224040
-
-
8.54
829.7163
DG 38:2; [M+NH4]+@8.55
DG 38:2
ME223852
-
-
8.55
666.6033
DG 38:2; [M+NH4]+@8.58
DG 38:2
ME223853
-
-
8.58
666.6033
DG 35:0; [M+NH4]+@8.62
DG 35:0
ME223832
-
-
8.62
628.5877
SM 44:1; [M]+@8.66
SM 44:1;O2
ME224045
-
-
8.66
843.7319
PC 44:4; [M+H]+@8.68
PC 44:4
ME223949
-
-
8.68
894.6952
DG 38:1; [M+NH4]+@8.69
DG 38:1
ME223850
-
-
8.69
668.6189
PC 42:2; [M+H]+@8.76
PC 42:2
ME223941
-
-
8.76
870.6952
SM 44:1; [M]+@8.83
SM 44:1;O2
ME224046
-
-
8.83
843.7319
DG 36:0; [M+NH4]+@8.87
DG 36:0
ME223838
-
-
8.87
642.6033
DG 36:0; [M+NH4]+@8.88
DG 36:0
ME223839
-
-
8.88
642.6033
DG 38:1; [M+NH4]+@8.95
DG 38:1
ME223851
-
-
8.95
668.6189
TG 52:5; [M+NH4]+@9.05
TG 52:5
ME224118
-
-
9.05
870.7546
TG 40:1; [M+NH4]+@9.15
TG 40:1
ME224051
-
-
9.15
710.6295
CE(20:5); [M+NH4]+@9.20
CE 20:5
ME223800
10372299
-
9.2
688.6032
CE(18:3); [M+NH4]+@9.22
CE 18:3
ME223791
6436907
-
9.22
664.6032
TG 42:2; [M+NH4]+@9.22
TG 42:2
ME224056
-
-
9.22
736.6451
TG 52:4; [M+NH4]+@9.31
TG 52:4
ME224115
-
-
9.31
872.7702
TG 54:5; [M+NH4]+@9.36
TG 54:5
ME224148
-
-
9.36
898.7859
TG 40:0; [M+NH4]+@9.45
TG 40:0
ME224049
-
-
9.45
712.6451
TG 40:0; [M+NH4]+@9.50
TG 40:0
ME224050
-
-
9.5
712.6451
TG 42:1; [M+NH4]+@9.51
TG 42:1
ME224054
-
-
9.51
738.6608
TG 42:1; [M+NH4]+@9.53
TG 42:1
ME224055
-
-
9.53
738.6608
TG 44:2; [M+NH4]+@9.54
TG 44:2
ME224059
-
-
9.54
764.6764
TG 44:2; [M+NH4]+@9.56
TG 44:2
ME224060
-
-
9.56
764.6764
TG 46:3; [M+NH4]+@9.60
TG 46:3
ME224067
-
-
9.6
790.6921
TG 52:7; [M+NH4]+@9.65
TG 52:7
ME224120
-
-
9.65
866.7233
TG 51:3; [M+NH4]+@9.67
TG 51:3
ME224103
-
-
9.67
860.7702
TG 54:8; [M+NH4]+@9.73
TG 54:8
ME224152
-
-
9.73
892.739
TG 42:0; [M+NH4]+@9.74
TG 42:0
ME224052
-
-
9.74
740.6764
TG 50:5; [M+NH4]+@9.75
TG 50:5
ME224093
-
-
9.75
842.7233
TG 50:5; [M+NH4]+@9.77
TG 50:5
ME224094
-
-
9.77
842.7233
TG 42:0; [M+NH4]+@9.79
TG 42:0
ME224053
-
-
9.79
740.6764
TG 58:11; [M+NH4]+@9.80
TG 58:11
ME224184
-
-
9.8
942.7546
TG 46:2; [M+NH4]+@9.81
TG 46:2
ME224065
-
-
9.81
792.7077
TG 58:11; [M+NH4]+@9.81
TG 58:11
ME224185
-
-
9.81
942.7546
TG 44:1; [M+NH4]+@9.82
TG 44:1
ME224057
-
-
9.82
766.6921
TG 44:1; [M+NH4]+@9.83
TG 44:1
ME224058
-
-
9.83
766.6921
TG 52:6; [M+NH4]+@9.85
TG 52:6
ME224119
-
-
9.85
868.739
TG 56:9; [M+NH4]+@9.85
TG 56:9
ME224178
-
-
9.85
918.7546
TG 62:14; [M+NH4]+@9.85
TG 62:14
ME224209
-
-
9.85
992.7702
TG 46:2; [M+NH4]+@9.86
TG 46:2
ME224066
-
-
9.86
792.7077
TG 48:3; [M+NH4]+@9.87
TG 48:3
ME224074
-
-
9.87
818.7233
TG 51:2; [M+NH4]+@9.87
TG 51:2
ME224100
-
-
9.87
862.7859
TG 60:12; [M+NH4]+@9.90
TG 60:12
ME224204
-
-
9.9
968.7702
TG 48:3; [M+NH4]+@9.91
TG 48:3
ME224075
-
-
9.91
818.7233
TG 54:7; [M+NH4]+@9.92
TG 54:7
ME224150
-
-
9.92
894.7546
TG 54:7; [M+NH4]+@9.93
TG 54:7
ME224151
-
-
9.93
894.7546
TG 50:4; [M+NH4]+@9.94
TG 50:4
ME224091
-
-
9.94
844.739
TG 62:13; [M+NH4]+@9.96
TG 62:13
ME224208
-
-
9.96
994.7859
TG 50:4; [M+NH4]+@9.97
TG 50:4
ME224092
-
-
9.97
844.739
TG 58:10; [M+NH4]+@9.97
TG 58:10
ME224182
-
-
9.97
944.7702
TG 53:6; [M+NH4]+@9.98
TG 53:6
ME224135
-
-
9.98
882.7546
TG 58:10; [M+NH4]+@9.98
TG 58:10
ME224183
-
-
9.98
944.7702
Analysis: C18 POSITIVE ION MODE/Triple quadrupole
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
12:1 CARNITINE
CAR 12:1
ME224306
87087953
-
-
-
14:1 CARNITINE
CAR 14:1
ME224307
87088002
-
-
-
14:2 CARNITINE
CAR 14:2
ME224305
87087940
-
-
-
16:1 CARNITINE
CAR 16:1
ME224303
76040365
-
-
-
18:3 CARNITINE
CAR 18:3
ME224293
54500892
-
-
-
3-HYDROXYLAUROYLCARNITINE
CAR 12:0;OH
ME224299
71464535
-
-
-
3-HYDROXYLINOLEYLCARNITINE
CAR 18:2;OH
ME224302
71464556
-
-
-
3-HYDROXYMYRISTOYLCARNITINE
CAR 14:0;OH
ME224300
71464541
-
-
-
3-HYDROXYPALMITOYLCARNITINE
CAR 16:0;3OH
ME224301
71464553
-
-
-
8:1 CARNITINE
CAR 8:1
ME224304
77908888
-
-
-
AC1MIY4G
-
ME224289
3082079
-
-
-
ACETYL-DL-CARNITINE
CAR 2:0
ME224281
1
-
-
-
ARACHIDONYL CARNITINE
CAR 20:4
ME224290
53477832
-
-
-
ARACHIDYL CARNITINE
CAR 20:0
ME224291
53477833
-
-
-
BUTYRYLCARNITINE
CAR 4:0
ME224287
213144
-
-
-
CIS-4-DECENOYL CARNITINE
CAR 10:1
ME224294
57357170
-
-
-
DECANOYLCARNITINE
CAR 10:0
ME224282
10245190
-
-
-
DL-CARNITINE
Carnitine
ME224288
288
-
-
-
GLUTARYLCARNITINE
CAR DC5:0
ME224298
71317118
-
-
-
ISOVALERYLCARNITINE
CAR 4:0;3Me
ME224295
6426851
-
-
-
LAUROYLCARNITINE
CAR 12:0
ME224283
10427569
-
-
-
LINOELAIDYL CARNITINE
CAR 18:2(9E,12E)
ME224292
53477834
-
-
-
L-PALMITOYLCARNITINE
CAR 16:0
ME224285
11953816
-
-
-
MYRISTOYLCARNITINE
CAR 14:0
ME224296
6426854
-
-
-
OLEOYLCARNITINE
CAR 18:1
ME224297
6441392
-
-
-
O-OCTANOYLCARNITINE
CAR 8:0
ME224286
123701
-
-
-
PROPIONYLCARNITINE
CAR 3:0
ME224284
107738
-
-
-
Analysis: C18 POSITIVE ION MODE/Triple quadrupole
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
(11Z,14Z)-ICOSADIENOYLCARNITINE
CAR 20:2
ME224326
71464509
-
-
-
12:1 CARNITINE
CAR 12:1
ME224334
87087953
-
-
-
14:1 CARNITINE
CAR 14:1
ME224335
87088002
-
-
-
14:2 CARNITINE
CAR 14:2
ME224333
87087940
-
-
-
16:1 CARNITINE
CAR 16:1
ME224331
76040365
-
-
-
18:3 CARNITINE
CAR 18:3
ME224319
54500892
-
-
-
3-HYDROXYLAUROYLCARNITINE
CAR 12:0;OH
ME224327
71464535
-
-
-
3-HYDROXYLINOLEYLCARNITINE
CAR 18:2;OH
ME224330
71464556
-
-
-
3-HYDROXYMYRISTOYLCARNITINE
CAR 14:0;OH
ME224328
71464541
-
-
-
3-HYDROXYPALMITOYLCARNITINE
CAR 16:0;3OH
ME224329
71464553
-
-
-
8:1 CARNITINE
CAR 8:1
ME224332
77908888
-
-
-
AC1MIY4G
-
ME224316
3082079
-
-
-
ACETYL-DL-CARNITINE
CAR 2:0
ME224308
1
-
-
-
ARACHIDONYL CARNITINE
CAR 20:4
ME224317
53477832
-
-
-
BUTYRYLCARNITINE
CAR 4:0
ME224314
213144
-
-
-
CIS-4-DECENOYL CARNITINE
CAR 10:1
ME224320
57357170
-
-
-
DECANOYLCARNITINE
CAR 10:0
ME224309
10245190
-
-
-
DL-CARNITINE
Carnitine
ME224315
288
-
-
-
GLUTARYLCARNITINE
CAR DC5:0
ME224325
71317118
-
-
-
ISOVALERYLCARNITINE
CAR 4:0;3Me
ME224321
6426851
-
-
-
LAUROYLCARNITINE
CAR 12:0
ME224310
10427569
-
-
-
LINOELAIDYL CARNITINE
CAR 18:2(9E,12E)
ME224318
53477834
-
-
-
L-PALMITOYLCARNITINE
CAR 16:0
ME224312
11953816
-
-
-
MYRISTOYLCARNITINE
CAR 14:0
ME224322
6426854
-
-
-
OLEOYLCARNITINE
CAR 18:1
ME224324
6441392
-
-
-
O-OCTANOYLCARNITINE
CAR 8:0
ME224313
123701
-
-
-
PROPIONYLCARNITINE
CAR 3:0
ME224311
107738
-
-
-
STEAROYLCARNITINE
CAR 18:0
ME224323
6426855
-
-
-
Analysis: HILIC NEGATIVE ION MODE/Amino, Aminopropyl
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
ADENOSINE
Adenosine
ME224342
60961
-
-
-
DL-ASPARTIC ACID
Aspartic acid
ME224338
424
-
-
-
DL-GLUTAMIC ACID
Glutamic acid
ME224343
611
-
-
-
HEXOPYRANOSE
Hexose
ME224337
206
-
-
-
L-GLUTAMINE
Glutamine
ME224341
5961
-
-
-
OLEIC ACID
Oleic acid
ME224339
445639
-
-
-
STEARIC ACID
Stearic acid
ME224340
5281
-
-
-
XANTHINE
Xanthine
ME224336
1188
-
-
-
Analysis: HILIC NEGATIVE ION MODE/Nucleotides, Sugars
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
2-KETOGLUTARIC ACID
2-Oxoglutaric acid
ME224353
51
-
-
-
6-PHOSPHOGLUCONIC ACID
6-Phosphogluconic acid
ME224366
91493
-
-
-
ADENOSINE 5'-DIPHOSPHATE
ADP
ME224358
6022
-
-
-
ADENOSINE 5'-MONOPHOSPHATE
AMP
ME224359
6083
-
-
-
ADENOSINE TRIPHOSPHATE
ATP
ME224355
5957
-
-
-
BETA-NAD+
NAD+
ME224346
15938971
-
-
-
CITRIC ACID
Citric acid
ME224350
311
-
-
-
COENZYME II
NADP+
ME224347
15938972
-
-
-
D-ERYTHROSE 4-PHOSPHATE
Erythrose 4-phosphate
ME224345
122357
-
-
-
D-FRUCTOSE, 1,6-BIS(DIHYDROGEN PHOSPHATE)
Fructose 1,6-bisphosphate
ME224349
21125049
-
-
-
DIHYDROXYACETONE PHOSPHATE
Dihydroxyacetone phosphate
ME224361
668
-
-
-
FAD
FAD
ME224352
46906035
-
-
-
GLYCERALDEHYDE 3-PHOSPHATE
Glyceraldehyde 3-phosphate
ME224363
729
-
-
-
GLYCERATE 3-PHOSPHATE
3-Phosphoglyceric acid
ME224362
724
-
-
-
HYPOXANTHINE
Hypoxanthine
ME224365
790
-
-
-
LACTIC ACID
Lactic acid
ME224360
612
-
-
-
MALIC ACID
Malic acid
ME224354
525
-
-
-
NADH
NADH
ME224351
439153
-
-
-
PHOSPHOENOLPYRUVATE
Phosphoenolpyruvic acid
ME224344
1005
-
-
-
RIBOSE PHOSPHATE
Ribose 5-phosphate
ME224364
77982
-
-
-
ROBISON ESTER
Glucose 6-phosphate
ME224356
5958
-
-
-
SEDOHEPTULOSE 7-PHOSPHATE
Sedoheptulose 7-phosphate
ME224348
165007
-
-
-
SUCROSE
Sucrose
ME224357
5988
-
-
-
UCSD Metabolomics Workbench, a resource sponsored by the Common Fund of the National Institutes of Health
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Contact
NMDR Personnel