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CHEBI:167084 - 2-Ethyl-1-hexanethiol

ChEBI IDCHEBI:167084
ChEBI Name2-Ethyl-1-hexanethiol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H18S
Net Charge0
Average Mass146.299
Monoisotopic Mass146.11292
SMILESCCCCC(CC)CS
InChIInChI=1S/C8H18S/c1-3-5-6-8(4-2)7-9/h8-9H,3-7H2,1-2H3
InChIKeyUCJMHYXRQZYNNL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Tuber magnatum (ncbitaxon:42249) fruit body (BTO:0000487) MetaboLights (MTBLS808) Strain: Tuber magnatum Pico
ChEBI Ontology
Outgoing Relation(s)
2-Ethyl-1-hexanethiol (CHEBI:167084) is a alkanethiol (CHEBI:47908)
IUPAC Name 
2-ethylhexane-1-thiol
Manual XrefsDatabases
99613ChemSpider
HMDB0041477HMDB
Registry NumbersSources
CAS:7341-17-5ChemIDplus