Chem
J-GLOBAL ID：200907000425443658   Nikkaji number：J1.826.495A

10-Cyanoverticillene

10-シアノベェルチシレン
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： C21H33N
Molecular formula furigana： C21-H33-N
Molecular weight： 299.502
InChI： InChI=1S/C21H33N/c1-15-7-6-8-16(2)13-18(14-22)20-17(3)10-12-19(11-9-15)21(20,4)5/h8-9,17-20H,6-7,10-13H2,1-5H3/b15-9+,16-8+/t17?,18-,19+,20?/m1/s1
InChI key： LDEXHWXOZYHHGK-ORZCIEGISA-N
SMILES： CC1CC[C@@H]2C/C=C(\C)/CC/C=C(\C)/C[C@H](C#N)C1C2(C)C
Systematic name  (2)：
  • (2S,4E,8E,11R)-4,8,14,15,15-ペンタメチルビシクロ[9.3.1]ペンタデカ-4,8-ジエン-2-カルボニトリル
  • (2S,4E,8E,11R)-4,8,14,15,15-pentamethylbicyclo[9.3.1]pentadeca-4,8-diene-2-carbonitrile
Other name (3)：
  • (2S,4E,8E,11R)-4,8,14,15,15-Pentamethylbicyclo[9.3.1]pentadeca-4,8-diene-2-carbonitrile
  • 10-シアノベェルチシレン
  • 10-Cyanoverticillene
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