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CHEBI:229290 - 3,3-dimethyl-2-Hexanone

Default Structure
ChEBI IDCHEBI:229290
ChEBI Name3,3-dimethyl-2-Hexanone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H16O
Net Charge0
Average Mass128.215
Monoisotopic Mass128.12012
SMILESCCCC(C)(C)C(C)=O
InChIInChI=1S/C8H16O/c1-5-6-8(3,4)7(2)9/h5-6H2,1-4H3
InChIKeyLJZPWSZYYTUCDP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryctolagus cuniculus (ncbitaxon:9986) longissimus thoracis (BTO:0001651) MetaboLights (MTBLS8958)
ChEBI Ontology
Outgoing Relation(s)
3,3-dimethyl-2-Hexanone (CHEBI:229290) is a ketone (CHEBI:17087)
IUPAC Name 
3,3-dimethylhexan-2-one
Manual XrefsDatabases
30791ChemSpider