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CHEBI:187267 - 7-(Methylthio)heptanenitrile

Default Structure
ChEBI IDCHEBI:187267
ChEBI Name7-(Methylthio)heptanenitrile
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H15NS
Net Charge0
Average Mass157.282
Monoisotopic Mass157.09252
SMILESCSCCCCCCC#N
InChIInChI=1S/C8H15NS/c1-10-8-6-4-2-3-5-7-9/h2-6,8H2,1H3
InChIKeyMAMGGQVRQMBXMB-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
7-(Methylthio)heptanenitrile (CHEBI:187267) is a nitrile (CHEBI:18379)
IUPAC Name 
7-methylsulanylheptanenitrile
Manual XrefsDatabases
4478011ChemSpider
HMDB0031890HMDB