Chem
J-GLOBAL ID:200907027017588775   Nikkaji number:J2.621.035F

(1R,5S)-1-Phenyl-5-butyl-3-butoxy-8-oxabicyclo[3.2.1]octa-3-ene

(1R,5S)-1-フェニル-5-ブチル-3-ブトキシ-8-オキサビシクロ[3.2.1]オクタ-3-エン
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: C21H30O2
Molecular formula furigana: C21-H30-O2
Molecular weight: 314.469
InChI: InChI=1S/C21H30O2/c1-3-5-12-20-13-14-21(23-20,18-10-8-7-9-11-18)17-19(16-20)22-15-6-4-2/h7-11,16H,3-6,12-15,17H2,1-2H3/t20-,21+/m0/s1
InChI key: CMQMBNKHPMOEBH-LEWJYISDSA-N
SMILES: CCCCOC1=C[C@]2(CCCC)CC[C@](C1)(O2)c1ccccc1
Systematic name  (3):
  • (1R,5S)-1-フェニル-5-ブチル-3-ブトキシ-8-オキサビシクロ[3.2.1]オクタ-3-エン
  • (1S,5R)-3-ブトキシ-1-ブチル-5-フェニル-8-オキサビシクロ[3.2.1]オクタ-2-エン
  • (1S,5R)-3-butoxy-1-butyl-5-phenyl-8-oxabicyclo[3.2.1]oct-2-ene
Other name (1):
  • (1R,5S)-1-Phenyl-5-butyl-3-butoxy-8-oxabicyclo[3.2.1]octa-3-ene
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