Chem
J-GLOBAL ID：200907002466527370   Nikkaji number：J666.190D

(1β,2α,5α,6β)-Tricyclo[4.2.1.02,5]nona-3,7-diene-3,4-dicarbonitrile

(1β,2α,5α,6β)-トリシクロ[4.2.1.02,5]ノナ-3,7-ジエン-3,4-ジカルボニトリル
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： C11H8N2
Molecular formula furigana： C11-H8-N2
Molecular weight： 168.199
InChI： InChI=1S/C11H8N2/c12-4-8-9(5-13)11-7-2-1-6(3-7)10(8)11/h1-2,6-7,10-11H,3H2/t6-,7+,10-,11+
InChI key： RXOHRZZOFBUDBB-BJPCUFFRSA-N
SMILES： N#CC1=C(C#N)[C@@H]2[C@H]1[C@@H]1C[C@H]2C=C1
Systematic name  (3)：
  • (1β,2α,5α,6β)-トリシクロ[4.2.1.02,5]ノナ-3,7-ジエン-3,4-ジカルボニトリル
  • (1R,2R,5S,6S)-トリシクロ[4.2.1.02,5]ノナ-3,7-ジエン-3,4-ジカルボニトリル
  • (1R,2R,5S,6S)-tricyclo[4.2.1.02,5]nona-3,7-diene-3,4-dicarbonitrile
Other name (1)：
  • (1β,2α,5α,6β)-Tricyclo[4.2.1.02,5]nona-3,7-diene-3,4-dicarbonitrile
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