Chem
J-GLOBAL ID：200907022192913482   Nikkaji number：J69.951I

Norbotryal acetate

ノルボトリアールアセタート
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： C16H24O3
Molecular formula furigana： C16-H24-O3
Molecular weight： 264.365
InChI： InChI=1S/C16H24O3/c1-9-6-13(19-11(3)18)15-14(12(9)8-17)10(2)7-16(15,4)5/h8-10,13,15H,6-7H2,1-5H3/t9-,10-,13+,15-/m1/s1
InChI key： HAEYAYBKSHUKRO-FRWLMAKKSA-N
SMILES： C[C@@H]1CC(C)(C)[C@@H]2[C@H](C[C@@H](C)C(=C12)C=O)OC(=O)C
Systematic name  (3)：
  • (3R)-7α-アセチルオキシ-2,3,5,6,7,7aα-ヘキサヒドロ-1,1,3β,5α-テトラメチル-1H-インデン-4-カルボアルデヒド
  • (1R,3aS,4S,6R)-7-ホルミル-1,3,3,6-テトラメチル-2,3,3a,4,5,6-ヘキサヒドロ-1H-インデン-4-イル アセタート
  • (1R,3aS,4S,6R)-7-formyl-1,3,3,6-tetramethyl-2,3,3a,4,5,6-hexahydro-1H-inden-4-yl acetate
Other name (3)：
  • Norbotryal acetate
  • ノルボトリアールアセタート
  • (3R)-7α-Acetyloxy-2,3,5,6,7,7aα-hexahydro-1,1,3β,5α-tetramethyl-1H-indene-4-carbaldehyde
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