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CHEBI:64893 - bornane-2,6-dione

ChEBI IDCHEBI:64893
ChEBI Namebornane-2,6-dione
Stars
DefinitionA diketone that is bornane bearing two oxo substituents at positions 2 and 6.
Last Modified14 June 2012
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC10H14O2
Net Charge0
Average Mass166.220
Monoisotopic Mass166.09938
SMILESCC12C(=O)CC(CC1=O)C2(C)C
InChIInChI=1S/C10H14O2/c1-9(2)6-4-7(11)10(9,3)8(12)5-6/h6H,4-5H2,1-3H3
InChIKeyPCEVUTCFZAQRKV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
bornane-2,6-dione (CHEBI:64893) has parent hydride bornane (CHEBI:35783)
bornane-2,6-dione (CHEBI:64893) is a diketone (CHEBI:46640)
IUPAC Name 
1,7,7-trimethylbicyclo[2.2.1]heptane-2,6-dione
Synonyms  Source
2,6-diketobornaneChEBI
2,6-dioxobornaneChEBI
UniProt Name  Source
bornane-2,6-dioneUniProt
Manual XrefsDatabases
CPD-14304MetaCyc
Registry NumbersSources
Reaxys:1943384Reaxys
Reaxys:7267639Reaxys
CAS:1935-17-7Reaxys
Citations