Chem
J-GLOBAL ID：200907044174043881   Nikkaji number：J580.360H

(1R)-3,6β-Dimethyl-2,4-cyclohexadiene-1β,2-dicarboxylic acid 1-methyl 2-benzyl ester

(1R)-3,6β-ジメチル-2,4-シクロヘキサジエン-1β,2-ジカルボン酸1-メチル2-ベンジル
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： C18H20O4
Molecular formula furigana： C18-H20-O4
Molecular weight： 300.354
InChI： InChI=1S/C18H20O4/c1-12-9-10-13(2)16(15(12)17(19)21-3)18(20)22-11-14-7-5-4-6-8-14/h4-10,12,15H,11H2,1-3H3/t12-,15-/m1/s1
InChI key： IKQCVWXUHLRAJK-IUODEOHRSA-N
SMILES： COC(=O)[C@@H]1[C@H](C)C=CC(=C1C(=O)OCc1ccccc1)C
Systematic name  (3)：
  • (1R)-3,6β-ジメチル-2,4-シクロヘキサジエン-1β,2-ジカルボン酸1-メチル2-ベンジル
  • 2-ベンジル 1-メチル (1R,6R)-3,6-ジメチルシクロヘキサ-2,4-ジエン-1,2-ジカルボキシラート
  • 2-benzyl 1-methyl (1R,6R)-3,6-dimethylcyclohexa-2,4-diene-1,2-dicarboxylate
Other name (1)：
  • (1R)-3,6β-Dimethyl-2,4-cyclohexadiene-1β,2-dicarboxylic acid 1-methyl 2-benzyl ester
Thsaurus map：
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