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Return to study ST003278 main page
Analysis: HILIC POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
5-Aminopentanamide
5-Aminopentanamide
ME860156
-
-
0.093
99.09192
Amfepramone
-
ME860169
-
-
0.119
433.28306
Levallorphan
Levallorphan
ME860257
-
-
0.3275
284.201865
Isoquinoline
Isoquinoline
ME860250
-
-
0.364
130.06507
1-Nitrosopiperidine
-
ME860092
-
-
0.412
97.07643
2-Hydroxyphenethylamine
2-Hydroxyphenethylamine
ME860113
-
-
0.415
120.080875
Istamycin C1
-
ME860251
-
-
0.518
432.2793
2-Dodecylbenzenesulfonic acid
2-Dodecylbenzenesulfonic acid
ME860111
-
-
0.531
344.22697
SteroidO-sulfate
-
ME860350
-
-
0.539
337.1457
Methyl N-formylnorleucylleucylphenylalaninate
-
ME860268
-
-
0.617
650.89451
4-Imidazolemethanol
-
ME860148
-
-
0.817
99.05557
13-hydroxy-alpha-tocopherol
-
ME860086
-
-
0.83
438.377055
Moxisylyte
-
ME860277
-
-
0.8665
280.190355
4-(1-Hydroxy-2-{[6-(4-hydroxy-4-phenylbutoxy)hexyl...
-
ME860141
-
-
0.868
432.27578
Forasartan
-
ME860231
-
-
0.893
417.25275
(6E)-5-Hydroxy-4-{[(1R,2S,5S)-2-hydroxy-5-isoprope...
-
ME860062
-
-
0.909
519.31279
Amide C22
-
ME860171
-
-
0.95775
340.356675
anacardic acid
Anacardic acid
ME860175
-
-
0.958
349.27306
N-benzyl-N-isopropyl-N'-[4-(trifluoromethoxy)pheny...
-
ME860293
-
-
0.9625
166.08599
2-(3-Hydroxy-3,7,11,15-tetramethylhexadecyl)-3,5,6...
-
ME860097
-
-
0.963
435.37529
N-Acetyl-O-demethylpuromycin
-
ME860290
-
-
0.971
500.22385
BORRELINE
Borreline
ME860183
-
-
0.973
267.14879
Orange OT
-
ME860318
-
-
0.98
245.11046
Leupeptin
Leupeptin
ME860256
-
-
0.986
427.30177
Piperlonguminine
-
ME860332
-
-
0.991
410.71105
N-Acetyl-D-quinovosamine
-
ME860289
-
-
1.003
206.10186
6-fluoro-3,4-dihydro-2H-pyrano[2,3-b]quinolin-5-am...
-
ME860159
-
-
1.008
219.094652
5,5',6,6'-Tetrahydro-3',6'-epoxy-beta,beta-caroten...
-
ME860154
-
-
1.017
619.43768
[FAhydroxy(20:3)]11_12-dihydroxy-5Z_8Z_14Z-eicosat...
-
ME860072
-
-
1.017
339.25217
MACAMIDE 1
-
ME860261
-
-
10.30521739
346.3096952
(+)-exo-5-Hydroxycamphor
-
ME860038
-
-
1.031
169.12201
Norethindrone
Norethindrone
ME860308
-
-
1.038
299.19989
GibberellinA12
-
ME860234
-
-
1.045
333.20526
TO0127900
-
ME860355
-
-
10.46666667
180.489
Dimethylaminopropionylphenothiazine
-
ME860213
-
-
1.0495
299.12063
WLH
-
ME860368
-
-
1.0525
437.234675
Tridemorph
Tridemorph
ME860359
-
-
10.53321212
298.3097491
(2Z,4E)-1-(1-Piperidinyl)-2,4-icosadien-1-one
-
ME860053
-
-
10.53626667
373.9550193
9-cis-Retinoicacid
9-cis-Retinoic acid
ME860163
-
-
1.0575
301.21557
4-Methoxyaniline
p-Anisidine
ME860149
-
-
10.62128571
133.6644514
jesaconitine
-
ME860252
-
-
1.064
676.32943
Coniine
Coniine
ME860195
-
-
1.065333333
128.14333
Cyclohexapyrazine
-
ME860201
-
-
10.66675
135.091515
ethyl 1-{[1-benzyl-3-(tert-butyl)-1H-pyrazol-5-yl]...
-
ME860225
-
-
1.0678
393.844228
Tridecyl 4-hydroxybenzenepropanoate
-
ME860358
-
-
1.071
349.27278
3-(Isothiocyanatomethyl)-1H-indole
-
ME860127
-
-
1.077
221.07376
tinoridine
-
ME860354
-
-
1.078
299.12084
Cyclohexylamine
Cyclohexylamine
ME860202
-
-
10.84091667
106.9500375
Benzylamine
Benzylamine
ME860181
-
-
10.9363913
116.2239787
Leucamine
-
ME860254
-
-
11.00478947
88.11248105
N-tert-Butyloxycarbonyl-deacetyl-leupeptin
-
ME860314
-
-
1.112
517.36934
1-Phenylethylamine
-
ME860095
-
-
11.1705
128.481255
[FA(20:3)]11_12-epoxy-5Z_8Z_14Z-eicosatrienoicacid
-
ME860069
-
-
1.13
321.2419
Gabapentin
Gabapentin
ME860232
-
-
11.329
172.13284
Pheneturide
-
ME860326
-
-
1.133
430.24281
Pantothenicacid(VitaminB5)
Pantothenic acid
ME860320
-
-
1.136
220.11771
heptaminol
-
ME860238
-
-
1.1415
128.143355
Candoxatril
-
ME860187
-
-
1.1445
516.29388
NP-022076
-
ME860311
-
-
1.16375
410.240685
2-Dimethylamino-5,6-dimethyl-4-hydroxypyrimidine
-
ME860110
-
-
11.711
168.11276
Cyclohexane
Cyclohexane
ME860200
-
-
1.175
85.10141
Phentermine
-
ME860328
-
-
11.801
154.13376
Amorolfine
-
ME860173
-
-
11.81564706
318.2784806
Inspra
-
ME860248
-
-
1.186
415.21021
Piperazine
Piperazine
ME860330
-
-
11.94972727
91.55137636
Diethanolamine
Diethanolamine
ME860212
-
-
12.0007
100.683359
ethyl 2-{4-[(4-methoxyphenyl)methylene]-5-oxo-2-ph...
-
ME860226
-
-
1.210666667
365.1562867
Buclizine
Buclizine
ME860184
-
-
1.216
433.24013
Ethephon
-
ME860222
-
-
12.24
144.98184
(5S)-5-hydroxy-1,7-diphenylheptan-3-one
-
ME860061
-
-
1.235571429
295.7354729
2,4-Dimethyl-5,6,7,8-tetrahydroquinoline
-
ME860103
-
-
12.35666667
162.1274633
9-fluoro-17?-oxa-dextro-homoandrosta-1,4-diene-3,1...
-
ME860164
-
-
1.255
333.15068
Melagatran
-
ME860263
-
-
1.273
430.242445
3-Phosphonooxypyruvate
Phosphohydroxypyruvic acid
ME860139
-
-
12.8525
184.98521
2-Methylpropanaloxime
2-Methylpropanal oxime
ME860120
-
-
12.87884615
91.23200692
4-(1,2-Dihydroxy-2-propanyl)-1-methyl-1,2-cyclohex...
-
ME860140
-
-
12.886
222.16951
Tryptoline
-
ME860362
-
-
1.318
173.1071042
1_4-Lactone
-
ME860083
-
-
1.326666667
190.10709
(24R_24'R)-Fucosterolepoxide
-
ME860041
-
-
1.332333333
429.3716117
Pent-1-ene
-
ME860323
-
-
1.33375
79.599105
Tocainide
Tocainide
ME860356
-
-
13.418
193.1332
1,2-Dihydropyrimidine
-
ME860076
-
-
13.48963636
89.05583682
AL9450000
-
ME860167
-
-
13.503
85.076475
(3Z,6E)-N-Hydroxy-2,4,4,7-tetramethyl-6,8-nonadien...
-
ME860057
-
-
13.595
242.210905
3-(7'-Hydroxy-4b',8',8',10a'-tetramethyl-5-oxotetr...
-
ME860126
-
-
13.695
610.37005
Nicotinamide
Niacinamide
ME860301
-
-
1.370111111
123.0553011
Dicyclohexylamine
N,N-Dicyclohexylamine
ME860209
-
-
13.71514286
182.19004
3-Methyl-3-phenylazetidine
-
ME860136
-
-
13.73
165.13832
(2E,6Z)-N-Ethyl-2,6-nonadienamide
-
ME860046
-
-
13.747
182.15369
2-Pentylpyridine
-
ME860122
-
-
1.379111111
161.4784444
EJ4025000
-
ME860219
-
-
13.923
159.1489
Pinidine
Pinidine
ME860329
-
-
13.932
164.4939367
Naphthalen-2-amine
2-Aminonaphthalene
ME860291
-
-
13.991
144.08073
N-Acetoxy-4-aminobiphenyl
-
ME860288
-
-
1.400333333
278.5666189
Deanol
Dimethylethanolamine
ME860206
-
-
14.016
90.09179333
(R)-2-Methylimino-1-phenylpropan-1-ol
(R)-2-Methylimino-1-phenylpropan-1-ol
ME860064
-
-
14.016
181.13334
Pseudopelletierine
psi-Pelletierine
ME860336
-
-
14.093
154.12256
4-Aminopyridine
4-Aminopyridine
ME860146
-
-
14.15283333
95.06074833
2-Ethyl-4,5-dimethylthiazole
-
ME860112
-
-
1.416
126.09137
Cyanopyrazine
Cyanopyrazine
ME860198
-
-
14.172
106.03938
Phenethylamineglucuronide
-
ME860325
-
-
1.418
298.12775
tuaminoheptane
-
ME860363
-
-
14.18975
116.1434825
LQ1825000
-
ME860259
-
-
14.191
144.4577667
Acetylcadaverine
N-Acetylcadaverine
ME860165
-
-
14.221
145.13348
3-Epihydroxy-2'-deoxymugineicacid
-
ME860133
-
-
14.2776
321.130414
Crotono-betaine
-
ME860197
-
-
14.314
142.12262
1,5-Methano-1H,3H,11H-furo(3,4-g)pyrano(3,2-b)xant...
-
ME860079
-
-
1.434
629.31148
Fingolimod
-
ME860228
-
-
14.374
308.25777
3-Amino-5,7-dimethyl-1-adamantanol
-
ME860131
-
-
14.389
196.16947
(2R)-2-{[(2R)-2-{[(2S,3R,4R,5S,6R)-3-Acetamido-2,5...
-
ME860051
-
-
14.4105
365.156735
Leucinamide
-
ME860255
-
-
14.449
122.11269
(4-amino-1,2,5-oxadiazol-3-yl)(1-pyrrolidinyl)meth...
-
ME860058
-
-
1.45
198.0973511
voxtalisib
-
ME860367
-
-
14.561
271.13032
Pyridoxamine;2-Methyl-4-aminomethyl-5-hydroxymethy...
-
ME860338
-
-
14.621
169.09696
(2E,4Z)-N-Isobutyl-2,4-decadienamide
-
ME860043
-
-
14.625
224.20022
N,N-Dimethyl-N-phenylurea
-
ME860282
-
-
14.735
165.10204
Cyclo(leucylprolyl)
-
ME860199
-
-
14.74
211.14391
Stachydrine
Stachydrine
ME860349
-
-
14.911
144.1017
Benzamidine
Benzamidine
ME860180
-
-
14.984
153.10214
N8ONU3L3PG
-
ME860287
-
-
1.515
473.263845
Tris(hydroxymethyl)aminomethane
2-Amino-2-methylol-propane-1,3-diol
ME860360
-
-
1.5225
201.595665
4,4'-diapolycopenedial
-
ME860143
-
-
1.55
429.27886
N-(2,6,10,14-Tetramethylpentadecanoyl)glycine
-
ME860280
-
-
1.552
356.315435
3-Indolepropionicacid
3-Indolepropionic acid
ME860135
-
-
1.567666667
203.7614033
Miglitol
Miglitol
ME860273
-
-
1.598
208.1175813
MM3670000
-
ME860276
-
-
1.59825
294.1656725
Netilmicin
Netilmicin
ME860296
-
-
1.623
476.30559
N-Pentacosanoylglycine
-
ME860312
-
-
1.644
440.4088471
Levamisole hydrochloride
Levamisole
ME860258
-
-
1.679958333
205.0790096
3-(1-Piperazinyl)benzisothiazole
-
ME860125
-
-
1.69225
220.0897575
N1-bicyclo[2.2.1]hept-2-yl-2-{4-[(dipropylamino)su...
-
ME860286
-
-
1.70275
453.208405
(4S)-4-hydroxy-3,5,5-trimethyl-4-[(1E)-3-{[(2R,3R,...
-
ME860060
-
-
1.751333333
409.1827733
APM
-
ME860176
-
-
1.776
208.117475
(R)-Acetoin
-
ME860065
-
-
1.803
89.06016
(2S)-3-Phenyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(...
-
ME860052
-
-
1.83
328.13822
3-[(6-Oxodecanoyl)oxy]-4-(trimethylammonio)butanoa...
-
ME860129
-
-
1.852666667
330.2266067
rac-Etomidate
-
ME860341
-
-
1.879
245.12813
Mycocyclosin
-
ME860278
-
-
1.884
325.117355
n-Dibutyl sulfide
-
ME860295
-
-
1.885
147.12061
Militarinone A
Militarinone A
ME860274
-
-
1.89
460.2679957
mesaconitine
Mesaconitine
ME860266
-
-
1.896
632.30359
4-Nitroaniline
4-Nitroaniline
ME860151
-
-
1.934
139.05005
2-Amino-3-hydroxy-15-methyl-1-hexadecanesulfonic a...
-
ME860108
-
-
1.9568
352.252206
Heptaethylene Glycol
Heptaethylene glycol
ME860237
-
-
1.982333333
327.2003967
N-cyclohexyl-1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazo...
-
ME860294
-
-
2.075
251.18458
2-[(11Z,14Z)-icosadienoyl]-sn-glycero-3-phosphoeth...
-
ME860105
-
-
2.1015
506.32315
Mefenamic acid
Mefenamic acid
ME860262
-
-
2.151
242.11679
ethyl 1-(4-methylphenyl)-1H-[1,2,4]triazolo[4,3-a]...
-
ME860224
-
-
2.197
321.12996
4-Methyl-2-propyloxazole
-
ME860150
-
-
2.205
167.11752
4-Trimethylammoniobutanal
-
ME860152
-
-
2.224
130.12244
NP-016596
-
ME860310
-
-
2.225666667
409.18219
butoctamide
-
ME860185
-
-
2.2546875
316.2110456
7-Aminomethyl-7-deazaguanine
7-Aminomethyl-7-carbaguanine
ME860162
-
-
2.26
180.08755
valpromide
-
ME860366
-
-
2.329
144.13804
RH0365500
-
ME860342
-
-
2.338
160.13307
N-Methyldioctylamine
-
ME860304
-
-
2.3765
256.29923
trans-2-Dodecenoylcarnitine
CAR 12:1(2E)
ME860357
-
-
2.409666667
342.2627967
(2E,4Z,12E)-1-(1-Piperidinyl)-2,4,12-octadecatrien...
-
ME860044
-
-
2.421
346.309375
N-Undecanoylglycine
NA-Gly 11:0
ME860315
-
-
2.504
244.1901
Quwenzhi
-
ME860340
-
-
2.565
216.159145
[FA(16:2)]N-hexadecyl-ethanolamine
Palmitoyl-EA
ME860068
-
-
2.569428571
300.2888314
1-(1Z,9Z-octadecadienyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-...
-
ME860073
-
-
2.697
774.54039
Phenmetrazine
Phenmetrazine
ME860327
-
-
2.704
194.13534
4,6-Diamino-5-formamidopyrimidine
FAPy-adenine
ME860144
-
-
2.776
154.071965
prolintane
-
ME860334
-
-
2.777
218.18979
NP-008993
-
ME860309
-
-
2.8004
337.2396
Orphenadrine
Orphenadrine
ME860319
-
-
2.82
270.18425
N-Methyl-(R_S)-tetrahydrobenzylisoquinoline
-
ME860303
-
-
2.878
270.18459
6-methyltetrahydropterin
6-Methyltetrahydropterin
ME860161
-
-
2.88075
182.1032263
Methylcyclopentane
-
ME860269
-
-
2.895
102.12798
1-hexadecanoyl-2-[(11Z)-octadec-9-enoyl]-sn-glycer...
-
ME860088
-
-
2.908
749.52904
Atipamezole
-
ME860179
-
-
2.917
213.13797
Hexadecanamide;Palmiticamide
-
ME860239
-
-
2.917
256.2628775
Minoxidil
-
ME860275
-
-
2.917
210.13465
3-Methylcyclopentene
-
ME860137
-
-
2.929
100.11231
(R_S)-Tetrahydrobenzylisoquinoline
-
ME860066
-
-
2.9295
240.15582
dicyclohexylcarbodiimide
-
ME860210
-
-
2.936
207.18507
Ethoxyquin
Ethoxyquin
ME860223
-
-
2.947
235.17996
flutriafol
-
ME860230
-
-
2.95
302.10977
N-benzyl-4-ethyl-N-isopropylbenzamide
-
ME860292
-
-
2.954
282.19068
EPTAZOCINE
-
ME860220
-
-
2.955
232.16915
C18-Carnitine
CAR 18:0
ME860186
-
-
2.959
428.372095
Fasoracetam
Fasoracetam
ME860227
-
-
2.964
197.128075
N_N-Dimethyltryptamine
-
ME860284
-
-
2.995
189.13809
(2R)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,16,19-Do...
-
ME860049
-
-
2.998
856.58367
3-Nonyl-1H-pyrazole
-
ME860138
-
-
3.008
195.18528
Tapentadol
-
ME860351
-
-
3.048
222.18461
2-(3-Phenylpropyl)pyridine
-
ME860098
-
-
3.053
198.127275
Myristamide
-
ME860279
-
-
3.083
228.23162
Dexamisole
-
ME860208
-
-
3.105375
205.07904
PC
-
ME860321
-
-
3.113
878.566935
MFCD00135289
-
ME860271
-
-
3.114
782.56863
1-Methylguanine
1-Methylguanine
ME860090
-
-
3.117166667
166.0719283
allopurinol
Allopurinol
ME860168
-
-
3.127428571
137.0454657
246I1D7TDL
-
ME860106
-
-
3.13
190.15845
fluphenazine enanthate
-
ME860229
-
-
3.167
550.26944
1,2-Dipalmitoleoyl-sn-glycero-3-phosphocholine
PC 16:1/16:1
ME860077
-
-
3.173
730.53627
Cetrimonium
-
ME860191
-
-
3.185
284.330413
(2E,6Z)-N-Cyclopropyl-2,6-nonadienamide
-
ME860045
-
-
3.2105
194.153555
Huperzine
-
ME860242
-
-
3.278
243.148595
Arachidonoyl Serinol
-
ME860177
-
-
3.304
378.30256
1-stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolami...
PE 18:0/18:1
ME860096
-
-
3.372
746.5678
2-arachidonyl-sn-glycero-3-phosphoethanolamine
-
ME860109
-
-
3.373
502.29131
3-[(4E,7E,10E,13E,16E,19E)-4,7,10,13,16,19-Docosah...
-
ME860128
-
-
3.386
472.34075
11-Nitro-1-undecene
-
ME860085
-
-
3.392
200.165445
Menaquinone 8
Menaquinone
ME860264
-
-
3.428
717.56045
D-Phenylalanine
D-Phenylalanine
ME860216
-
-
3.468666667
166.0859
[FA]O-Palmitoyl-R-carnitine
CAR 16:0
ME860070
-
-
3.469
400.34099
ammodendrine
Ammodendrine
ME860172
-
-
3.469333333
203.1608067
DD9275000
-
ME860205
-
-
3.48525
133.075901
N-Stearoyltyrosine
-
ME860313
-
-
3.502
448.34077
MFCD22416941
-
ME860272
-
-
3.514
426.356405
Dimethylbenzimidazole
Dimethylbenzimidazole
ME860214
-
-
3.532
147.09142
1-[(8Z,11Z,14Z)-icosatrienoyl]-sn-glycero-3-phosph...
-
ME860080
-
-
3.558
568.33778
5,5-dimethyl-3-morpholinocyclohex-2-en-1-one
-
ME860155
-
-
3.566
210.14821
(2R)-2-[(5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-Icosapent...
-
ME860050
-
-
3.578
808.58197
5-Methoxy-N_N-dimethyltryptamine
-
ME860157
-
-
3.578
219.148565
CETABEN
-
ME860190
-
-
3.595
356.3007983
Bethanidine
-
ME860182
-
-
3.598
178.133385
lysophosphatidylethanolamine (22:6(4Z,7Z,10Z,13Z,1...
-
ME860260
-
-
3.664666667
526.2912033
1-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholine
-
ME860081
-
-
3.764
494.32264
1-Palmitoylglycerophosphocholine
LPC 16:0/0:0
ME860094
-
-
3.7655
496.33823
1-arachidonoyl-sn-glycero-3-phosphocholine
LPC 20:4/0:0
ME860087
-
-
3.791
544.3383
Cholinephosphate
Choline phosphate
ME860193
-
-
3.84
184.0728
(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3...
-
ME860048
-
-
3.843
500.2754
1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glyce...
-
ME860074
-
-
3.852
568.3381533
(cyclohexylmethyl)pyrazine
-
ME860063
-
-
3.854666667
187.81362
Guanine
Guanine
ME860235
-
-
3.859
152.05631
1-Linoleoylglycerophosphocholine
LPC 18:2
ME860089
-
-
3.861
520.33834
Capryloylglycine
-
ME860188
-
-
3.9396
347.44179
2-methylbutyrylcarnitine
CAR 4:0;2Me
ME860117
-
-
4.045
246.1693
Inosine
Inosine
ME860247
-
-
4.045
269.08717
Tyrosyl-4-hydroxyproline
-
ME860364
-
-
4.124
295.12796
HMBA
-
ME860241
-
-
4.159
201.15927
N-(6-Aminohexanoyl)-6-aminohexanoate
-
ME860281
-
-
4.168
552.37544
1-Oleoylglycerophosphocholine
LPC 18:1/0:0
ME860093
-
-
4.19075
522.35386
deoxyhypusine
Deoxyhypusine
ME860207
-
-
4.202
218.18559
Piperidine
Piperidine
ME860331
-
-
4.20256
86.0968296
sedamine
-
ME860344
-
-
4.218
220.16905
ODA
-
ME860317
-
-
4.229833333
270.3147333
Methyl alpha-aspartylphenylalaninate
-
ME860267
-
-
4.23
295.12797
N-{(2S,3R,4E)-3-Hydroxy-1-[(3-O-sulfo-beta-D-threo...
-
ME860285
-
-
4.24
864.6206
Ser-Ser
Ser-Ser
ME860346
-
-
4.2455
210.109245
(4E)-2-Amino-3-oxo-4-undecenoic acid
-
ME860059
-
-
4.313
246.16937
2-Methyl-6-[(1E)-1-propenyl]pyrazine
-
ME860115
-
-
4.36
135.09142
4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethylmorph...
-
ME860142
-
-
4.364
167.11752
(3S)-3-(Pentanoyloxy)-4-(trimethylammonio)butanoat...
-
ME860055
-
-
4.378
246.16926
(2R)-1-[(2S,4R,5Z)-4-Benzyl-2,5-dihydroxy-5-{[(1R,...
-
ME860047
-
-
4.492
523.3308
D-Tryptophan
D-Tryptophan
ME860218
-
-
4.523
205.09669
Indoleacrylicacid
Indoleacrylic acid
ME860246
-
-
4.5385
205.09662
Cytidine;1-beta-delta-Ribofuranosyl-Cytosine
-
ME860203
-
-
4.547
244.09212
4-[(1S)-1-Cyclohexyl-2-(2-piperidinyl)ethyl]cycloh...
-
ME860145
-
-
4.558363636
289.3667809
WS1228A
-
ME860369
-
-
4.561
208.14381
2-Allyl-6-methylpyrazine
-
ME860107
-
-
4.58
135.09141
2,5-Diethyl-3,6-dimethylpyrazine
-
ME860104
-
-
4.606
165.138475
Pyrazolidine
-
ME860337
-
-
4.619
114.10254
(3S)-3_6-Diaminohexanoate
-
ME860056
-
-
4.62
147.1124
2-Phenylcyclopropanamine
-
ME860123
-
-
4.6315
171.6251975
Indane
-
ME860245
-
-
4.66825
123.3421375
Guanosine
Guanosine
ME860236
-
-
4.672
284.09813
2,2'-Iminodipropan-1-ol
-
ME860100
-
-
4.717
134.1173
3-Dehydroxycarnitine
3-Dehydroxycarnitine
ME860132
-
-
4.737446429
146.1172911
2,3-Diethyl-5-methylpyrazine
-
ME860101
-
-
4.79075
167.135775
4-Guanidinobutanal
4-Guanidinobutanal
ME860147
-
-
4.798
130.09729
Nigrifactin
-
ME860302
-
-
4.895
181.4807758
N-Heptadecanoylglycine
-
ME860298
-
-
4.902166667
514.42276
Imagabalin
-
ME860244
-
-
4.9786
180.55378
2-(6'-methylthio)hexylmalate
-
ME860099
-
-
4.986
265.11086
N-Nitrosodiethylamine
N-Nitrosodiethylamine
ME860307
-
-
5.043
103.08685
Selsun
-
ME860345
-
-
5.098
112.895795
Choline
Choline
ME860192
-
-
5.18886
104.1071817
3-Amino-3-(4-hydroxyphenyl)propanoate
beta-Tyrosine
ME860130
-
-
5.195
182.08098
Solasodine
Solasodine
ME860347
-
-
5.209538462
414.3354831
6-{[2-(2-oxo-1-imidazolidinyl)ethyl]amino}-2-pyrid...
-
ME860158
-
-
5.212
210.13315
D-Methionine
D-Methionine
ME860215
-
-
5.23
150.05806
Taurine
Taurine
ME860352
-
-
5.304
126.0218
Rilmenidine
Rilmenidine
ME860343
-
-
5.346666667
254.8518967
D-Proline
D-Proline
ME860217
-
-
5.393
116.07066
PEG-4
-
ME860322
-
-
5.410318182
205.5357673
Hexylamine
Hexylamine
ME860240
-
-
5.558333333
102.1279667
Acetyl-L-carnitine
CAR 2:0
ME860166
-
-
5.757
204.1229
6-Methylnicotinamide
6-Methylnicotinamide
ME860160
-
-
5.934
197.8488025
tetridamine
-
ME860353
-
-
6.1475
182.14657
gamma-Coniceine
gamma-Coniceine
ME860233
-
-
6.260911765
137.9294909
(-)-Lupinine
Lupinine
ME860037
-
-
6.26675
194.1731375
2-Methylpyrrolidine
2-Methyl pyrrolidine
ME860121
-
-
6.3276
86.09688
(2E,4E,16Z)-1-(1-Piperidinyl)-2,4,16-icosatrien-1-...
-
ME860042
-
-
6.375714286
374.3409093
Pregabalin
Pregabalin
ME860333
-
-
6.545333333
160.1330178
(S)-Carnitine
Carnitine
ME860067
-
-
6.5635
162.11212
(3R)-beta-Leucine
beta-Leucine
ME860054
-
-
6.608363636
132.1017848
N-Methylphenylethanolamine
-
ME860305
-
-
6.81
172.6200925
4-Vinylpyridine
-
ME860153
-
-
6.856142857
106.0653224
Amphetamine
Dextroamphetamine
ME860174
-
-
6.961722222
148.4088061
(+)-N-Methylconiine
-
ME860039
-
-
6.987428571
148.0197643
Phenelzine
-
ME860324
-
-
6.992666667
145.1070933
Isoleucine - 6C13
-
ME860249
-
-
7.0294
138.12177
NFP
-
ME860297
-
-
7.04
146.1173229
Capsi-amide
Capsiamide
ME860189
-
-
7.090777778
270.2785822
2,4-Diaminotoluene
-
ME860102
-
-
7.258
123.091735
Amide C18
-
ME860170
-
-
7.2855
300.30743
Tropinone
Tropinone
ME860361
-
-
7.36475
168.6265325
1,1'-(3,5-Pyridinediyl)di(1-decanone)
-
ME860075
-
-
7.526
388.3199
solenopsin
-
ME860348
-
-
7.636
254.283755
Pyrrolidine
Pyrrolidine
ME860339
-
-
7.644086957
103.10612
2-Isobutyl-3-methoxypyrazine
-
ME860114
-
-
7.68425
167.1176625
IE1225000
-
ME860243
-
-
7.787
104.11796
[FAamino(5:0)]2S-amino-pentanoicacid
2S-Aminopentanoic acid
ME860071
-
-
7.861129032
118.086319
D-2-Amino-hexano-6-lactam
Undecylprodigiosin
ME860204
-
-
7.8945
111.091895
1-Methylpyrrolinium
1-Methylpyrrolinium
ME860091
-
-
7.8985
167.153945
2-Methyl-6-undecylpiperidine
-
ME860116
-
-
7.951705882
254.2836865
(2,7-Dimethyloctahydro-1H-cyclopenta[c]pyridin-4-y...
-
ME860040
-
-
8.0285
208.18883
1,4-Dimethylimidazole
-
ME860078
-
-
8.185818182
97.07636455
Octylamine
Octylamine
ME860316
-
-
8.24325
130.1588588
3-Guanidinopropanoate
3-Guanidinopropanoic acid
ME860134
-
-
8.321875
132.0766113
ethambutol
Ethambutol
ME860221
-
-
8.330857143
205.1907414
Atagabalin
-
ME860178
-
-
8.415
200.5894007
Ciclopirox
Ciclopirox
ME860194
-
-
8.569
208.133095
1_2-Diaminobenzene
-
ME860082
-
-
8.752
121.886564
n-Hexanamide
-
ME860299
-
-
8.788666667
116.1071253
Lauramide
-
ME860253
-
-
8.9242
200.200598
Mexiletine
Mexiletine
ME860270
-
-
9.0395
180.137915
Propylhexedrine
-
ME860335
-
-
9.099
156.17462
mephentermine
Mephentermine
ME860265
-
-
9.209636364
167.2388873
11-Aminoundecanoic acid
11-Aminoundecanoic acid
ME860084
-
-
9.224533333
202.1797383
2S-Amino-tridecanoic acid
2S-Aminotridecanoic acid
ME860124
-
-
9.261
230.210998
N-Methylpyridinium
N-Methylpyridinium
ME860306
-
-
9.425366667
100.308492
N-Hydroxydecanamide
N-Decanohydroxamic acid
ME860300
-
-
9.453230769
196.0226
2-Methylcholine
2-Methylcholine
ME860118
-
-
9.455714286
118.1227
Dicyclomine
-
ME860211
-
-
9.546625
312.4016888
2-MethylpropanalO-methyloxime
-
ME860119
-
-
9.635163265
102.0916214
N_N-Dimethylsphing-4-enine
-
ME860283
-
-
9.881666667
328.3204433
Creatinine
Creatinine
ME860196
-
-
9.908909091
114.0662773
UNII:6S7S02945H
-
ME860365
-
-
9.999166667
228.2135633
Analysis: HILIC NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
Zonisamide
Zonisamide
ME860382
-
-
0.917
211.01794
Myristyl sulfate
-
ME860377
-
-
0.948
293.17958
NP-012534
-
ME860378
-
-
0.954
265.14809
Imafen
-
ME860374
-
-
12.4355
186.103135
indanazoline
-
ME860375
-
-
13.516
200.118865
tolonidine
-
ME860379
-
-
13.735
208.06424
Allopurinol
Allopurinol
ME860372
-
-
2.696
135.03014
Xanthine
Xanthine
ME860381
-
-
3.48
151.02546
meglumine
-
ME860376
-
-
4.527
194.10284
Didanosine
Didanosine
ME860373
-
-
5.4368
235.083598
1D-chiro-inositol
1D-chiro-Inositol
ME860370
-
-
5.444
202.058515
1-Methoxypyrene
-
ME860371
-
-
5.684
231.08158
tramazoline
-
ME860380
-
-
9.996
214.1347
UCSD Metabolomics Workbench, a resource sponsored by the Common Fund of the National Institutes of Health
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