Chem
J-GLOBAL ID：200907043527784434
Nikkaji number：J2.469.516F
(R)-2-Phenacyloctanal
(R)-2-フェナシルオクタナール
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： C16H22O2
Molecular formula furigana： C16-H22-O2
Molecular weight： 246.350
InChI：
InChI=1S/C16H22O2/c1-2-3-4-6-9-14(13-17)12-16(18)15-10-7-5-8-11-15/h5,7-8,10-11,13-14H,2-4,6,9,12H2,1H3/t14-/m1/s1
InChI key：
NKMHFARGXSDPKY-CQSZACIVSA-N
SMILES：
CCCCCC[C@H](CC(=O)c1ccccc1)C=O
Systematic name (5)：
- (R)-1-フェニル-3-ヘキシル-1,4-ブタンジオン
- (R)-2-フェナシルオクタナール
- (R)-2-(β-オキソフェネチル)オクタナール
- (2R)-2-(2-オキソ-2-フェニルエチル)オクタナール
- (2R)-2-(2-oxo-2-phenylethyl)octanal
- (R)-1-Phenyl-3-hexyl-1,4-butanedione
- (R)-2-Phenacyloctanal
- (R)-2-(β-Oxophenethyl)octanal
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