Chem
J-GLOBAL ID：200907066143375910
Nikkaji number：J2.065.287J
1β-Cyano-1,2,5,6,7,7a-hexahydro-1,7aβ-dimethyl-4H-indene-4-one
1β-シアノ-1,2,5,6,7,7a-ヘキサヒドロ-1,7aβ-ジメチル-4H-インデン-4-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： C12H15NO
Molecular formula furigana： C12-H15-N-O
Molecular weight： 189.258
InChI：
InChI=1S/C12H15NO/c1-11(8-13)7-5-9-10(14)4-3-6-12(9,11)2/h5H,3-4,6-7H2,1-2H3/t11-,12+/m1/s1
InChI key：
XFCMEOVJTUJOPO-NEPJUHHUSA-N
SMILES：
C[C@@]1(CC=C2C(=O)CCC[C@]12C)C#N
Systematic name (4)：
- (1S)-1,7aβ-ジメチル-4-オキソ-1,4,5,6,7,7a-ヘキサヒドロ-2H-インデン-1β-カルボニトリル
- 1β-シアノ-1,2,5,6,7,7a-ヘキサヒドロ-1,7aβ-ジメチル-4H-インデン-4-オン
- (1S,7aR)-1,7a-ジメチル-4-オキソ-2,4,5,6,7,7a-ヘキサヒドロ-1H-インデン-1-カルボニトリル
- (1S,7aR)-1,7a-dimethyl-4-oxo-2,4,5,6,7,7a-hexahydro-1H-indene-1-carbonitrile
- (1S)-1,7aβ-Dimethyl-4-oxo-1,4,5,6,7,7a-hexahydro-2H-indene-1β-carbonitrile
- 1β-Cyano-1,2,5,6,7,7a-hexahydro-1,7aβ-dimethyl-4H-indene-4-one
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