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Return to study ST002250 main page
Analysis: Reversed phase POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
Valeric acid
Valeric acid
ME543322
-
-
14.26
103,07565
Creatinine
Creatinine
ME543262
-
-
2.59
114,06619
L-Proline
Proline
ME543293
-
-
2.73
116,07058
Indole
Indole
ME543275
-
-
7.41
118,06506
L-Valine
Valine
ME543296
-
-
2.95
118,08622
Phenylacetaldehyde
Phenylacetaldehyde
ME543307
-
-
13.91
121,0649
Benzoic acid
Benzoic acid
ME543257
-
-
4.35
123,04397
Pyroglutamic acid
Pyroglutamic acid
ME543313
-
-
8.48
130,0498
Pipecolic acid
Pipecolic acid
ME543310
-
-
3.4
130,08623
N-Acetylputrescine
N-Acetylputrescine
ME543299
-
-
2.63
131,11789
Creatine
Creatine
ME543261
-
-
2.6
132,07675
3-Methylindole
3-Methylindole
ME543242
-
-
7.41
132,08074
L-Norleucine
Norleucine
ME543291
-
-
8.6
132,10189
2-Hydroxycaproic acid
2-Hydroxyhexanoic acid
ME543236
-
-
13.18
133,08597
Hypoxanthine
Hypoxanthine
ME543274
-
-
6.19
137,04573
Phenylacetic acid
Phenylacetic acid
ME543308
-
-
11.81
137,05969
3-Hexenedioic acid
3-Hexenedioic acid
ME543240
-
-
3.39
145,04944
Phenylpropiolic acid
Phenylpropiolic acid
ME543309
-
-
4.34
147,04422
2,2-Dimethylsuccinic acid
2,2-Dimethylsuccinic acid
ME543235
-
-
13.91
147,06525
Cinnamic acid
trans-Cinnamic acid
ME543259
-
-
6.57
149,05972
Guanine
Guanine
ME543271
-
-
6.18
152,05676
Acetaminophen
Acetaminophen
ME543249
-
-
7.35
152,07062
Oxypurinol
Oxypurinol
ME543302
-
-
4.21
153,0407
3,5-Dimethoxyphenol
-
ME543239
-
-
9.69
155,07037
L-Histidine
Histidine
ME543289
-
-
1.66
156,07683
DL-2-aminooctanoic acid
2-Aminocaprylic acid
ME543267
-
-
8.25
160,13331
L-Carnitine
Carnitine
ME543288
-
-
2.56
162,11252
m-Coumaric acid
trans-m-Coumaric acid
ME543297
-
-
4.39
165,05466
L-Phenylalanine
Phenylalanine
ME543292
-
-
6.57
166,08623
Benzocaine
Benzocaine
ME543256
-
-
8.75
166,08632
3-Methylxanthine
3-Methylxanthine
ME543243
-
-
6.4
167,0564
Uric acid
Uric acid
ME543320
-
-
3.66
169,0356
Pyridoxamine
Pyridoxamine
ME543312
-
-
6.72
169,09712
Indole-3-carbinol
Indole-3-carbinol
ME543276
-
-
7.41
170,06007
Norepinephrine
Norepinephrine
ME543300
-
-
7.1
170,08127
L-Arginine
Arginine
ME543286
-
-
1.7
175,11904
Indoleacetic acid
Indoleacetic acid
ME543277
-
-
10.69
176,07067
Serotonin
Serotonin
ME543314
-
-
7.21
177,10234
Paraxanthine
Paraxanthine
ME543305
-
-
7.47
181,07203
o-Tyrosine
o-Tyrosine
ME543301
-
-
4.37
182,08124
9-Methyluric acid
9-Methyluric acid
ME543248
-
-
6.43
183,05124
Indoleacrylic acid
Indoleacrylic acid
ME543278
-
-
7.96
188,07063
Glycyl-L-leucine
Gly-Leu
ME543270
-
-
6.13
189,12354
Kynurenic acid
Kynurenic acid
ME543284
-
-
8.08
190,04997
3-Indolepropionic acid
3-Indolepropionic acid
ME543241
-
-
11.56
190,08633
5-Hydroxyindoleacetic acid
5-Hydroxyindoleacetic acid
ME543245
-
-
6.51
192,06563
4-Aminohippuric acid
4-Aminohippuric acid
ME543244
-
-
6.46
195,07396
Caffeine
Caffeine
ME543258
-
-
8.17
195,08771
Hippuric acid
Hippuric acid
ME543273
-
-
8.57
202,04758
L-Sorbose
Sorbose
ME543294
-
-
2.37
203,05267
L-Acetylcarnitine
CAR 2:0
ME543285
-
-
3.39
204,12314
L-Tryptophan
Tryptophan
ME543295
-
-
7.41
205,09715
Indolelactic acid
Indolelactic acid
ME543279
-
-
9.88
206,08123
L-Kynurenine
Kynurenine
ME543290
-
-
6.52
209,09217
Pantothenic acid
Pantothenic acid
ME543303
-
-
6.97
220,11806
Traumatic acid
Traumatic acid
ME543317
-
-
10.48
229,1421
Paracetamol sulfate
Paracetamol sulfate
ME543304
-
-
7.48
232,02759
5-Methoxytryptophan
5-Methoxytryptophan
ME543246
-
-
7.42
235,10781
3,4,5-Trimethoxycinnamic acid
3,4,5-Trimethoxycinnamic acid
ME543238
-
-
9.64
239,09129
Uridine
Uridine
ME543321
-
-
14.36
245,07864
Isovalerylcarnitine
CAR 4:0;3Me
ME543283
-
-
7.77
246,17007
Glycerophosphocholine
sn-Glycero-3-phosphocholine
ME543269
-
-
3.48
258,1103
Alpha-N-phenylacetyl-L-glutamine
alpha-N-Phenylacetylglutamine
ME543253
-
-
8.48
265,11824
Inosine
Inosine
ME543280
-
-
6.19
269,08812
L-Aspartyl-L-phenylalanine
Asp-Phe
ME543287
-
-
7.42
281,11331
1-Methyladenosine
1-Methyladenosine
ME543234
-
-
6.59
282,11973
5a-Androstane-3b,17b-diol
5alpha-Androstane-3beta,17beta-diol
ME543247
-
-
18.59
293,2478
Aspartame
Aspartame
ME543254
-
-
6.67
295,12898
All-trans-retinoic acid
Retinoic acid
ME543252
-
-
14.81
301,21644
Sphinganine
Sphinganine
ME543315
-
-
12.71
302,30553
DUMP
dUMP
ME543268
-
-
3.48
309,04937
Pregnenolone
Pregnenolone
ME543311
-
-
18.84
317,24781
Acetaminophen glucuronide
p-Acetamidophenylglucuronide
ME543250
-
-
6.54
350,0848
Cortisol
Cortisol
ME543260
-
-
11.23
363,21672
Deoxycholic acid glycine conjugate
Glycodeoxycholic acid
ME543265
-
-
13.85
450,3218
Guanosine 5'-triphosphate
GTP
ME543272
-
-
13.99
524,00034
Trimethylamine
Trimethylamine
ME543318
-
-
7.96
60,08091
Urea
Urea
ME543319
-
-
2.69
61,03978
Acrylamide
Acrylamide
ME543251
-
-
8
72,04453
N,N-Dimethylformamide
N,N-Dimethylformamide
ME543298
-
-
4.38
74,06022
Azythromycin
Azithromycin
ME543255
-
-
14.03
749,51226
Thyroxine
Thyroxine
ME543316
-
-
11.7
777,69379
PC(18:1(9Z)/18:1(9Z))
PC 18:1(9Z)/18:1(9Z)
ME543306
-
-
17.83
786,60068
2-Pyrrolidinone
2-Pyrrolidinone
ME543237
-
-
2.6
86,06028
Diacetyl
Diacetyl
ME543266
-
-
15.08
87,04424
Iso-Valeraldehyde
Iso-Valeraldehyde
ME543281
-
-
15.71
87,08063
Isobutyric acid
Isobutyric acid
ME543282
-
-
13.89
89,05985
D-Alanine
D-Alanine
ME543264
-
-
7.49
90,05234
Cyclohexanone
Cyclohexanone
ME543263
-
-
15.4
99,08071
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