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CHEBI:229251 - 3-Hexanone-2,2,4,4-d4

Default Structure
ChEBI IDCHEBI:229251
ChEBI Name3-Hexanone-2,2,4,4-d4
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC6H8D4O
Net Charge0
Average Mass104.185
Monoisotopic Mass104.11392
SMILES[2H]C([2H])(C)C(=O)C([2H])([2H])CC
InChIInChI=1S/C6H12O/c1-3-5-6(7)4-2/h3-5H2,1-2H3/i4D2,5D2
InChIKeyPFCHFHIRKBAQGU-CQOLUAMGSA-N
Species of MetaboliteComponentSourceComments
Oryctolagus cuniculus (ncbitaxon:9986) longissimus thoracis (BTO:0001651) MetaboLights (MTBLS8958)
ChEBI Ontology
Outgoing Relation(s)
3-Hexanone-2,2,4,4-d4 (CHEBI:229251) is a ketone (CHEBI:17087)
IUPAC Name 
2,2,4,4-tetradeuteriohexan-3-one
Manual XrefsDatabases
107439623ChemSpider