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CHEBI:87404 - bicyclo[2.2.2]octane-2,6-dione

ChEBI IDCHEBI:87404
ChEBI Namebicyclo[2.2.2]octane-2,6-dione
Stars
DefinitionAn alicyclic ketone that is bicyclo[2.2.2]octane carrying two oxo groups located at positions 2 and 6.
Last Modified21 August 2015
Submittergemma
DownloadsMolfile
FormulaC8H10O2
Net Charge0
Average Mass138.166
Monoisotopic Mass138.06808
SMILESO=C1CC2CCC1C(=O)C2
InChIInChI=1S/C8H10O2/c9-7-3-5-1-2-6(7)8(10)4-5/h5-6H,1-4H2
InChIKeyVXBMHPUAHFEJAV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
bicyclo[2.2.2]octane-2,6-dione (CHEBI:87404) is a alicyclic ketone (CHEBI:36132)
bicyclo[2.2.2]octane-2,6-dione (CHEBI:87404) is a bridged compound (CHEBI:35990)
bicyclo[2.2.2]octane-2,6-dione (CHEBI:87404) is a β-diketone (CHEBI:67265)
IUPAC Name 
bicyclo[2.2.2]octane-2,6-dione
Registry NumbersSources
Reaxys:2247740Reaxys
Citations