Chem
J-GLOBAL ID：200907016530487265   Nikkaji number：J1.750.713C

1-(3β,6β-Methanocyclohexene-5α-ylcarbonyl)-3,5-dimethyl-1H-pyrazole

1-(3β,6β-メタノシクロヘキセン-5α-イルカルボニル)-3,5-ジメチル-1H-ピラゾール
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： C13H16N2O
Molecular formula furigana： C13-H16-N2-O
Molecular weight： 216.284
InChI： InChI=1S/C13H16N2O/c1-8-5-9(2)15(14-8)13(16)12-7-10-3-4-11(12)6-10/h3-5,10-12H,6-7H2,1-2H3/t10-,11+,12-/m0/s1
InChI key： YRVHIZIOIFVODA-TUAOUCFPSA-N
SMILES： Cc1cc(C)n(n1)C(=O)[C@H]1C[C@@H]2C[C@H]1C=C2
Systematic name  (7)：
  • (3,5-ジメチル-1H-ピラゾール-1-イル)[(1S,2S,4S)-ビシクロ[2.2.1]ヘプタ-5-エン-2-イル]ケトン
  • 1-[[(1β,4β)-ビシクロ[2.2.1]ヘプタ-2-エン-6α-イル]カルボニル]-3,5-ジメチル-1H-ピラゾール
  • [(1β,4β)-ビシクロ[2.2.1]ヘプタ-2-エン-6α-イル](3,5-ジメチル-1H-ピラゾール-1-イル)ケトン
  • (1α,4α)-5β-(3,5-ジメチル-1H-ピラゾール-1-イルカルボニル)ビシクロ[2.2.1]ヘプタ-2-エン
  • 1-(3β,6β-メタノシクロヘキセン-5α-イルカルボニル)-3,5-ジメチル-1H-ピラゾール
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Other name (5)：
  • (3,5-Dimethyl-1H-pyrazole-1-yl)[(1S,2S,4S)-bicyclo[2.2.1]hepta-5-ene-2-yl] ketone
  • 1-[[(1β,4β)-Bicyclo[2.2.1]hepta-2-ene-6α-yl]carbonyl]-3,5-dimethyl-1H-pyrazole
  • [(1β,4β)-Bicyclo[2.2.1]hepta-2-ene-6α-yl](3,5-dimethyl-1H-pyrazole-1-yl) ketone
  • (1α,4α)-5β-(3,5-Dimethyl-1H-pyrazole-1-ylcarbonyl)bicyclo[2.2.1]hepta-2-ene
  • 1-(3β,6β-Methanocyclohexene-5α-ylcarbonyl)-3,5-dimethyl-1H-pyrazole
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