Chem
J-GLOBAL ID：200907025312779938   Nikkaji number：J2.132.113C

(1β,2β,7β,8β)-3-Methyl-6-oxotricyclo[6.2.1.02,7]undeca-4,9-diene-3β-carbonitrile

(1β,2β,7β,8β)-3-メチル-6-オキソトリシクロ[6.2.1.02,7]ウンデカ-4,9-ジエン-3β-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： C13H13NO
Molecular formula furigana： C13-H13-N-O
Molecular weight： 199.253
InChI： InChI=1S/C13H13NO/c1-13(7-14)5-4-10(15)11-8-2-3-9(6-8)12(11)13/h2-5,8-9,11-12H,6H2,1H3/t8-,9+,11+,12+,13-/m1/s1
InChI key： KVESHTNPJAUAMO-PFZOXLDVSA-N
SMILES： C[C@@]1(C=CC(=O)[C@@H]2[C@H]3C[C@H](C=C3)[C@H]12)C#N
Systematic name  (3)：
  • (1β,2β,7β,8β)-3-メチル-6-オキソトリシクロ[6.2.1.02,7]ウンデカ-4,9-ジエン-3β-カルボニトリル
  • (1R,2S,3S,7R,8S)-3-メチル-6-オキソトリシクロ[6.2.1.02,7]ウンデカ-4,9-ジエン-3-カルボニトリル
  • (1R,2S,3S,7R,8S)-3-methyl-6-oxotricyclo[6.2.1.02,7]undeca-4,9-diene-3-carbonitrile
Other name (1)：
  • (1β,2β,7β,8β)-3-Methyl-6-oxotricyclo[6.2.1.02,7]undeca-4,9-diene-3β-carbonitrile
Thsaurus map：
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