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CHEBI:195965 - Calacone

ChEBI IDCHEBI:195965
ChEBI NameCalacone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O
Net Charge0
Average Mass220.356
Monoisotopic Mass220.18272
SMILESC=C(C)CCC1=C(C(C)C)CCC(C)C1=O
InChIInChI=1S/C15H24O/c1-10(2)6-8-14-13(11(3)4)9-7-12(5)15(14)16/h11-12H,1,6-9H2,2-5H3
InChIKeyGPXJKVFRKZAYCC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Calacone (CHEBI:195965) is a p-menthane monoterpenoid (CHEBI:25186)
IUPAC Name 
6-methyl-2-(3-methylbut-3-enyl)-3-propan-2-ylcyclohex-2-en-1-one
Manual XrefsDatabases
4474882ChemSpider
HMDB0038146HMDB