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CHEBI:36777 - (1S)-bornane-2,3-dione

ChEBI IDCHEBI:36777
ChEBI Name(1S)-bornane-2,3-dione
Stars
ASCII Name(1S)-bornane-2,3-dione
Last Modified12 October 2006
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC10H14O2
Net Charge0
Average Mass166.220
Monoisotopic Mass166.09938
SMILESCC1(C)[C@H]2CC[C@]1(C)C(=O)C2=O
InChIInChI=1S/C10H14O2/c1-9(2)6-4-5-10(9,3)8(12)7(6)11/h6H,4-5H2,1-3H3/t6-,10+/m0/s1
InChIKeyVNQXSTWCDUXYEZ-QUBYGPBYSA-N
ChEBI Ontology
Outgoing Relation(s)
(1S)-bornane-2,3-dione (CHEBI:36777) is a bornane-2,3-dione (CHEBI:34607)
(1S)-bornane-2,3-dione (CHEBI:36777) is enantiomer of (1R)-bornane-2,3-dione (CHEBI:36778)
Incoming Relation(s)
(1R)-bornane-2,3-dione (CHEBI:36778) is enantiomer of (1S)-bornane-2,3-dione (CHEBI:36777)
IUPAC Name 
(1S,4R)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,3-dione
Synonym  Source
(1S)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,3-dioneNIST Chemistry WebBook
Registry NumbersSources
Beilstein:2613999Beilstein
Beilstein:3649450Beilstein
CAS:2767-84-2ChemIDplus
CAS:2767-84-2NIST Chemistry WebBook