Chem
J-GLOBAL ID:200907050167933855   Nikkaji number:J1.655.812E

(1β)-2,2,4β-Trimethyl-3β-(2-methoxy-3-tert-butylphenyl)bicyclo[2.2.1]heptane-3-ol

(1β)-2,2,4β-トリメチル-3β-(2-メトキシ-3-tert-ブチルフェニル)ビシクロ[2.2.1]ヘプタン-3-オール
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: C21H32O2
Molecular formula furigana: C21-H32-O2
Molecular weight: 316.485
InChI: InChI=1S/C21H32O2/c1-18(2,3)15-9-8-10-16(17(15)23-7)21(22)19(4,5)14-11-12-20(21,6)13-14/h8-10,14,22H,11-13H2,1-7H3/t14-,20-,21-/m0/s1
InChI key: XZQHYDMNKPKBPM-WVFSVQOHSA-N
SMILES: COc1c(cccc1[C@@]1(O)[C@@]2(C)CC[C@@H](C2)C1(C)C)C(C)(C)C
Systematic name  (3):
  • (1β)-2,2,4β-トリメチル-3β-(2-メトキシ-3-tert-ブチルフェニル)ビシクロ[2.2.1]ヘプタン-3-オール
  • (1S,2R,4S)-2-(3-tert-ブチル-2-メトキシフェニル)-1,3,3-トリメチルビシクロ[2.2.1]ヘプタン-2-オール
  • (1S,2R,4S)-2-(3-tert-butyl-2-methoxyphenyl)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol
Other name (1):
  • (1β)-2,2,4β-Trimethyl-3β-(2-methoxy-3-tert-butylphenyl)bicyclo[2.2.1]heptane-3-ol
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