Chem
J-GLOBAL ID：200907023490987398   Nikkaji number：J1.810.776G

[1-Phenyl-2-(3,4-diethyl-6β-methyl-3-cyclohexene-1β-yl)ethyl]malononitrile

[1-フェニル-2-(3,4-ジエチル-6β-メチル-3-シクロヘキセン-1β-イル)エチル]マロノニトリル
Substance type：
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
Molecular formula： C22H28N2
Molecular formula furigana： C22-H28-N2
Molecular weight： 320.480
InChI： InChI=1S/C22H28N2/c1-4-17-11-16(3)20(12-18(17)5-2)13-22(21(14-23)15-24)19-9-7-6-8-10-19/h6-10,16,20-22H,4-5,11-13H2,1-3H3/t16-,20-,22?/m1/s1
InChI key： DOYIGJJPCXSKAD-XAHNPAKWSA-N
SMILES： CCC1=C(CC)C[C@H](CC(C(C#N)C#N)c2ccccc2)[C@H](C)C1
Systematic name  (3)：
  • [1-フェニル-2-(3,4-ジエチル-6β-メチル-3-シクロヘキセン-1β-イル)エチル]マロノニトリル
  • 2-{2-[(1S,6R)-3,4-ジエチル-6-メチルシクロヘキサ-3-エン-1-イル]-1-フェニルエチル}プロパンジニトリル
  • 2-{2-[(1S,6R)-3,4-diethyl-6-methylcyclohex-3-en-1-yl]-1-phenylethyl}propanedinitrile
Other name (1)：
  • [1-Phenyl-2-(3,4-diethyl-6β-methyl-3-cyclohexene-1β-yl)ethyl]malononitrile
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