Chem
J-GLOBAL ID：200907066423525844   Nikkaji number：J1.646.733B

(1R,3R,4S)-8-Phenyl-p-menthane-3β-ol 3-oxocyclohexene-1-carboxylate

3-オキソシクロヘキセン-1-カルボン酸(1R,3R,4S)-8-フェニル-p-メンタン-3-イル
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： C23H30O3
Molecular formula furigana： C23-H30-O3
Molecular weight： 354.490
InChI： InChI=1S/C23H30O3/c1-16-12-13-20(23(2,3)18-9-5-4-6-10-18)21(14-16)26-22(25)17-8-7-11-19(24)15-17/h4-6,9-10,15-16,20-21H,7-8,11-14H2,1-3H3/t16-,20-,21-/m1/s1
InChI key： OFFKDPWMAPSELF-MAODMQOUSA-N
SMILES： C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C1=CC(=O)CCC1)C(C)(C)c1ccccc1
Systematic name  (9)：
  • 3-オキソ-1-シクロヘキセン-1-カルボン酸3α-メチル-6β-(1-フェニル-1-メチルエチル)シクロヘキサン-1α-イル
  • 3-オキソ-1-シクロヘキセン-1-カルボン酸(1α)-3α-メチル-6β-(α,α-ジメチルベンジル)シクロヘキシル
  • 3-オキソシクロヘキセン-1-カルボン酸(1R,3R,4S)-8-フェニル-p-メンタン-3-イル
  • 3-オキソ-1-シクロヘキセン-1-カルボン酸(1R)-2α-(α,α-ジメチルベンジル)-5β-メチルシクロヘキサン-1β-イル
  • 3-オキソシクロヘキセン-1-カルボン酸2α-(α,α-ジメチルベンジル)-5β-メチルシクロヘキサン-1β-イル
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Other name (7)：
  • 3-Oxo-1-cyclohexene-1-carboxylic acid 3α-methyl-6β-(1-phenyl-1-methylethyl)cyclohexane-1α-yl ester
  • 3-Oxo-1-cyclohexene-1-carboxylic acid (1α)-3α-methyl-6β-(α,α-dimethylbenzyl)cyclohexyl ester
  • 3-Oxocyclohexene-1-carboxylic acid (1R,3R,4S)-8-phenyl-p-menthane-3-yl ester
  • 3-Oxo-1-cyclohexene-1-carboxylic acid (1R)-2α-(α,α-dimethylbenzyl)-5β-methylcyclohexane-1β-yl ester
  • 3-Oxocyclohexene-1-carboxylic acid 2α-(α,α-dimethylbenzyl)-5β-methylcyclohexane-1β-yl ester
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