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CHEBI:38563 - 3,3-dimethyl-1-(methylsulfanyl)butan-2-one

ChEBI IDCHEBI:38563
ChEBI Name3,3-dimethyl-1-(methylsulfanyl)butan-2-one
Stars
Last Modified18 June 2007
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC7H14OS
Net Charge0
Average Mass146.255
Monoisotopic Mass146.07654
SMILESCSCC(=O)C(C)(C)C
InChIInChI=1S/C7H14OS/c1-7(2,3)6(8)5-9-4/h5H2,1-4H3
InChIKeyMHHUUPYWCAKNBW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3,3-dimethyl-1-(methylsulfanyl)butan-2-one (CHEBI:38563) is a aliphatic sulfide (CHEBI:22327)
3,3-dimethyl-1-(methylsulfanyl)butan-2-one (CHEBI:38563) is a butanone (CHEBI:22951)
Incoming Relation(s)
3,3-dimethyl-1-(methylsulfanyl)butan-2-one oxime (CHEBI:38564) has functional parent 3,3-dimethyl-1-(methylsulfanyl)butan-2-one (CHEBI:38563)
IUPAC Name 
3,3-dimethyl-1-(methylsulfanyl)butan-2-one
Synonyms  Source
3,3-Dimethyl-1-methylthio-2-butanoneChemIDplus
3,3-Dimethyl-1-(methylthio)butan-2-oneChemIDplus
3,3-dimethyl-1-methylmercapto-2-butanoneChEBI
Registry NumbersSources
Beilstein:1747102Beilstein
CAS:39199-12-7ChemIDplus