Chem
J-GLOBAL ID：200907004321095858   Nikkaji number：J1.855.696K

(1R,2R,5S,6S,8S,9S)-2,6,10,10-Tetramethyl-2,5-epoxy-7-oxobicyclo[6.3.0]undecane-9-carbonitrile

(1R,2R,5S,6S,8S,9S)-2,6,10,10-テトラメチル-2,5-エポキシ-7-オキソビシクロ[6.3.0]ウンデカン-9-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： C16H23NO2
Molecular formula furigana： C16-H23-N-O2
Molecular weight： 261.365
InChI： InChI=1S/C16H23NO2/c1-9-12-5-6-16(4,19-12)10-7-15(2,3)11(8-17)13(10)14(9)18/h9-13H,5-7H2,1-4H3/t9-,10+,11-,12-,13+,16+/m0/s1
InChI key： MEGAMQFJSPMMNO-ZKNXGJCASA-N
SMILES： C[C@H]1[C@@H]2CC[C@@](C)(O2)[C@@H]2CC(C)(C)[C@@H](C#N)[C@@H]2C1=O
Systematic name  (4)：
  • 2,2,4,8α-テトラメチル-2,3,3aα,4,5,6,7,8,9,9aα-デカヒドロ-9-オキソ-4α,7α-エポキシ-1H-シクロペンタシクロオクテン-1α-カルボニトリル
  • (1R,2R,5S,6S,8S,9S)-2,6,10,10-テトラメチル-2,5-エポキシ-7-オキソビシクロ[6.3.0]ウンデカン-9-カルボニトリル
  • (1R,2R,5S,6S,8S,9S)-1,4,4,8-テトラメチル-7-オキソ-12-オキサトリシクロ[7.2.1.02,6]ドデカン-5-カルボニトリル
  • (1R,2R,5S,6S,8S,9S)-1,4,4,8-tetramethyl-7-oxo-12-oxatricyclo[7.2.1.02,6]dodecane-5-carbonitrile
Other name (2)：
  • 2,2,4,8α-Tetramethyl-2,3,3aα,4,5,6,7,8,9,9aα-decahydro-9-oxo-4α,7α-epoxy-1H-cyclopentacyclooctene-1α-carbonitrile
  • (1R,2R,5S,6S,8S,9S)-2,6,10,10-Tetramethyl-2,5-epoxy-7-oxobicyclo[6.3.0]undecane-9-carbonitrile
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