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CHEBI:179882 - 3-(Hydroxymethyl)-2-octanone

ChEBI IDCHEBI:179882
ChEBI Name3-(Hydroxymethyl)-2-octanone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H18O2
Net Charge0
Average Mass158.241
Monoisotopic Mass158.13068
SMILESCCCCCC(CO)C(C)=O
InChIInChI=1S/C9H18O2/c1-3-4-5-6-9(7-10)8(2)11/h9-10H,3-7H2,1-2H3
InChIKeyXLFYWCDNLLZTIW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-(Hydroxymethyl)-2-octanone (CHEBI:179882) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
3-(hydroxymethyl)octan-2-one
Manual XrefsDatabases
LMFA05000624LIPID MAPS
HMDB0037164HMDB
55979ChemSpider
Registry NumbersSources
CAS:59191-78-5ChemIDplus