Chem
J-GLOBAL ID：200907027444541828
Nikkaji number：J1.797.872A
3aα,6-Dimethyl-2,3,3a,4,7,8-hexahydroazulene-1-carbonitrile
3aα,6-ジメチル-2,3,3a,4,7,8-ヘキサヒドロアズレン-1-カルボニトリル
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： C13H17N
Molecular formula furigana： C13-H17-N
Molecular weight： 187.286
InChI：
InChI=1S/C13H17N/c1-10-3-4-12-11(9-14)6-8-13(12,2)7-5-10/h5H,3-4,6-8H2,1-2H3/t13-/m1/s1
InChI key：
KPXOMYUPCWFQSZ-CYBMUJFWSA-N
SMILES：
CC1=CC[C@]2(C)CCC(=C2CC1)C#N
Systematic name (3)：
- 3aα,6-ジメチル-2,3,3a,4,7,8-ヘキサヒドロアズレン-1-カルボニトリル
- (3aS)-3a,6-ジメチル-2,3,3a,4,7,8-ヘキサヒドロアズレン-1-カルボニトリル
- (3aS)-3a,6-dimethyl-2,3,3a,4,7,8-hexahydroazulene-1-carbonitrile
- 3aα,6-Dimethyl-2,3,3a,4,7,8-hexahydroazulene-1-carbonitrile
Return to Previous Page
