Chem
J-GLOBAL ID：200907085224227324
Nikkaji number：J1.520.628D
(S)-3-Oxocyclohexaneacetic acid
(S)-3-オキソシクロヘキサン酢酸
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： C8H12O3
Molecular formula furigana： C8-H12-O3
Molecular weight： 156.181
InChI：
InChI=1S/C8H12O3/c9-7-3-1-2-6(4-7)5-8(10)11/h6H,1-5H2,(H,10,11)/t6-/m0/s1
InChI key：
RYTWPAUCABOYJP-LURJTMIESA-N
SMILES：
OC(=O)C[C@H]1CCCC(=O)C1
Systematic name (7)：
- (1S)-3-オキソシクロヘキサン-1-酢酸
- (S)-3-オキソシクロヘキサン-1-酢酸
- (S)-3-オキソシクロヘキサン酢酸
- (1S)-3-オキソシクロヘキサン-1α-酢酸
- (3S)-1-オキソシクロヘキサン-3β-酢酸
Show all
- (1S)-3-Oxocyclohexane-1-acetic acid
- (S)-3-Oxocyclohexane-1-acetic acid
- (S)-3-Oxocyclohexaneacetic acid
- (1S)-3-Oxocyclohexane-1α-acetic acid
- (3S)-1-Oxocyclohexane-3β-acetic acid
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