Chem
J-GLOBAL ID:200907051785475902   Nikkaji number:J997.951D

(2R)-2α-tert-Butyl-4α-phenethyl-5β-methyl-6β-[(1S)-1-methyl-2-propenyl]-1,3-dioxane

(2R)-2α-tert-ブチル-4α-フェネチル-5β-メチル-6β-[(1S)-1-メチル-2-プロペニル]-1,3-ジオキサン
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/c1-7-15(2)19-16(3)18(22-20(23-19)21(4,5)6)14-13-17-11-9-8-10-12-17/h7-12,15-16,18-20H,1,13-14H2,2-6H3/t15-,16+,18+,19+,20+/m0/s1
InChI key: OSCPKWWPWBDVFH-APQLOABGSA-N
SMILES: C[C@@H](C=C)[C@H]1O[C@@H](O[C@H](CCc2ccccc2)[C@H]1C)C(C)(C)C
Systematic name  (3):
  • (2R)-2α-tert-ブチル-4α-フェネチル-5β-メチル-6β-[(1S)-1-メチル-2-プロペニル]-1,3-ジオキサン
  • (2R,4R,5R,6R)-4-[(2S)-ブタ-3-エン-2-イル]-2-tert-ブチル-5-メチル-6-(2-フェニルエチル)-1,3-ジオキサン
  • (2R,4R,5R,6R)-4-[(2S)-but-3-en-2-yl]-2-tert-butyl-5-methyl-6-(2-phenylethyl)-1,3-dioxane
Other name (1):
  • (2R)-2α-tert-Butyl-4α-phenethyl-5β-methyl-6β-[(1S)-1-methyl-2-propenyl]-1,3-dioxane
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