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CHEBI:173324 - Isopentyl mercaptan

Default Structure
ChEBI IDCHEBI:173324
ChEBI NameIsopentyl mercaptan
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC5H12S
Net Charge0
Average Mass104.218
Monoisotopic Mass104.06597
SMILESCC(C)CCS
InChIInChI=1S/C5H12S/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3
InChIKeyGIJGXNFNUUFEGH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Isopentyl mercaptan (CHEBI:173324) is a alkanethiol (CHEBI:47908)
IUPAC Name 
3-methylbutane-1-thiol
Manual XrefsDatabases
10462ChemSpider
HMDB0033902HMDB
Registry NumbersSources
CAS:541-31-1ChemIDplus