Terminology Service for NFDI4Health

3-mercaptohexyl acetate

Go to external page http://purl.obolibrary.org/obo/CHEBI_77818


An acetate ester obtained by formal O-acetylation of 3-mercaptohexanol.

Term info

Label

3-mercaptohexyl acetate

Synonyms
  • 3-sulfanylhexyl acetate
database cross reference
Subsets

3_STAR

IUPAC NAME
3-sulfanylhexyl acetate [ IUPAC ]

charge

0

formula

C8H16O2S

has obo namespace

chebi_ontology

id

CHEBI:77818

inchi

InChI=1S/C8H16O2S/c1-3-4-8(11)5-6-10-7(2)9/h8,11H,3-6H2,1-2H3

inchikey

JUCARGIKESIVLB-UHFFFAOYSA-N

mass

176.27600

monoisotopicmass

176.08710

smiles

CCCC(S)CCOC(C)=O