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Human Metabolome Database Version 3.5

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HMDB IDDouble
CAS Number
NameDouble Structure FormulaDouble
Average MassDouble
Mono MassDouble
Biofluid Location
HMDB40173
110-59-8
Pentanenitrile Thumb C5H9N
83.1317
83.073499293
HMDB40174
1124-39-6
4-Ethyl-1,2-benzenediol Thumb C8H10O2
138.1638
138.068079564
HMDB40175
2785-89-9
4-Ethyl-2-methoxyphenol Thumb C9H12O2
152.1904
152.083729628
HMDB40176
5888-51-7
4-Ethyl-1,2-dimethoxybenzene Thumb C10H14O2
166.217
166.099379692
HMDB40177
933-99-3
3-Ethyl-1,2-benzenediol Thumb C8H10O2
138.1638
138.068079564
HMDB40178
2444-28-2
2,6-Di-tert-butyl-1,4-benzenediol Thumb C14H22O2
222.3233
222.161979948
HMDB40179
4130-42-1
2,6-Di-tert-butyl-4-ethylphenol Thumb C16H26O
234.377
234.198365454
HMDB40180
2131-18-2
Pentadecylbenzene Thumb C21H36
288.5105
288.281701152
HMDB40181
Fagopyritol A2 Thumb C18H32O16
504.4371
504.169034976
HMDB40182
Fagopyritol A3 Thumb C24H42O21
666.5777
666.221858406
HMDB40184
6725-64-0
Methanedithiol Thumb CH4S2
80.172
79.975441508
HMDB40185
54812-86-1
3-Mercapto-2-butanol Thumb C4H10OS
106.187
106.045235632
HMDB40186
38433-74-8
3-(Methylthio)hexanal Thumb C7H14OS
146.25
146.07653576
HMDB40187
30957-55-2
1,1-Dibromo-1-chloro-2-propanone Thumb C3H3Br2ClO
250.316
247.823917719
HMDB40188
867-54-9
1,1-Dibromo-2-propanone Thumb C3H4Br2O
215.871
213.862890044
HMDB40189
59227-99-5
1,1-Dibromo-3-iodo-2-propanone Thumb C3H3Br2IO
341.768
339.759533432
HMDB40190
59227-98-4
1-Bromo-3-iodoacetone Thumb C3H4BrIO
262.872
261.849020817
HMDB40191
72590-78-4
(±)-2-Methylhexanal Thumb C7H14O
114.1855
114.10446507
HMDB40192
86594-16-3
N-Nitrosothiazolidine-4-carboxylic acid Thumb C4H6N2O3S
162.167
162.009912758
HMDB40193
123-29-5
Ethyl nonanoate Thumb C11H22O2
186.2912
186.161979948
HMDB40194
111-79-5
Methyl 2-nonenoate Thumb C10H18O2
170.2487
170.13067982
HMDB40195
106-32-1
Ethyl octanoate Thumb C10H20O2
172.2646
172.146329884
HMDB40196
2050-60-4
Oxalic acid dibutyl ester Thumb C10H18O4
202.2475
202.120509064
HMDB40197
55764-23-3
2,5-Dimethyl-3-furanthiol Thumb C6H8OS
128.192
128.029585568
HMDB40198
63359-63-7
2,5-Dimethyl-3-(methylthio)furan Thumb C7H10OS
142.219
142.045235632