Chem
J-GLOBAL ID：200907000774705872
Nikkaji number：J2.034.942E
(1β,5β)-3α-Methylbicyclo[3.2.1]octa-6-ene-2-one
(1β,5β)-3α-メチルビシクロ[3.2.1]オクタ-6-エン-2-オン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C9H12O
Molecular formula furigana： C9-H12-O
Molecular weight： 136.194
InChI：
InChI=1S/C9H12O/c1-6-4-7-2-3-8(5-7)9(6)10/h2-3,6-8H,4-5H2,1H3/t6-,7+,8+/m1/s1
InChI key：
DNZDYQJEAYUREJ-CSMHCCOUSA-N
SMILES：
C[C@@H]1C[C@H]2C[C@H](C=C2)C1=O
Systematic name (3)：
- (1β,5β)-3α-メチルビシクロ[3.2.1]オクタ-6-エン-2-オン
- (1R,3R,5S)-3-メチルビシクロ[3.2.1]オクタ-6-エン-2-オン
- (1R,3R,5S)-3-methylbicyclo[3.2.1]oct-6-en-2-one
- (1β,5β)-3α-Methylbicyclo[3.2.1]octa-6-ene-2-one
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