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CHEBI:169461 - Heptane-1-thiol

ChEBI IDCHEBI:169461
ChEBI NameHeptane-1-thiol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H16S
Net Charge0
Average Mass132.272
Monoisotopic Mass132.09727
SMILESCCCCCCCS
InChIInChI=1S/C7H16S/c1-2-3-4-5-6-7-8/h8H,2-7H2,1H3
InChIKeyVPIAKHNXCOTPAY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Heptane-1-thiol (CHEBI:169461) is a alkanethiol (CHEBI:47908)
IUPAC Name 
heptane-1-thiol
Manual XrefsDatabases
HMDB0032304HMDB
14680ChemSpider
Registry NumbersSources
CAS:1639-09-4ChemIDplus