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CHEBI:181453 - 6,6-Dimethylbicyclo[3.1.1]heptan-2-one

ChEBI IDCHEBI:181453
ChEBI Name6,6-Dimethylbicyclo[3.1.1]heptan-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H14O
Net Charge0
Average Mass138.210
Monoisotopic Mass138.10447
SMILESCC1(C)C2CCC(=O)C1C2
InChIInChI=1S/C9H14O/c1-9(2)6-3-4-8(10)7(9)5-6/h6-7H,3-5H2,1-2H3
InChIKeyXZFDKWMYCUEKSS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6,6-Dimethylbicyclo[3.1.1]heptan-2-one (CHEBI:181453) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
6,6-dimethylbicyclo[3.1.1]heptan-2-one
Manual XrefsDatabases
30341ChemSpider
Registry NumbersSources
CAS:24903-95-5ChemIDplus