Chem
J-GLOBAL ID：200907002095993187
Nikkaji number：J2.221.660K
(3aS)-5β-Phenyl-2,3,3aβ,4,5,7aα-hexahydro-1H-indene-4β-carbaldehyde
(3aS)-5β-フェニル-2,3,3aβ,4,5,7aα-ヘキサヒドロ-1H-インデン-4β-カルボアルデヒド
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
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
Molecular formula： C16H18O
Molecular formula furigana： C16-H18-O
Molecular weight： 226.319
InChI：
InChI=1S/C16H18O/c17-11-16-14-8-4-7-13(14)9-10-15(16)12-5-2-1-3-6-12/h1-3,5-6,9-11,13-16H,4,7-8H2/t13-,14+,15-,16-/m1/s1
InChI key：
RGKORNOLNXHWAW-QKPAOTATSA-N
SMILES：
O=C[C@@H]1[C@H]2CCC[C@@H]2C=C[C@@H]1c1ccccc1
Systematic name (3)：
- (3aS)-5β-フェニル-2,3,3aβ,4,5,7aα-ヘキサヒドロ-1H-インデン-4β-カルボアルデヒド
- (3aS,4R,5S,7aR)-5-フェニル-2,3,3a,4,5,7a-ヘキサヒドロ-1H-インデン-4-カルバルデヒド
- (3aS,4R,5S,7aR)-5-phenyl-2,3,3a,4,5,7a-hexahydro-1H-indene-4-carbaldehyde
- (3aS)-5β-Phenyl-2,3,3aβ,4,5,7aα-hexahydro-1H-indene-4β-carbaldehyde
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