Chem
J-GLOBAL ID：200907066961550298
Nikkaji number：J641.196G
(3aR,8aS)-オクタヒドロシクロヘプタ[d][1,3]ジオキソール-2-オン
(3aR,8aS)-オクタヒドロシクロヘプタ[d][1,3]ジオキソール-2-オン
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/c9-8-10-6-4-2-1-3-5-7(6)11-8/h6-7H,1-5H2/t6-,7+
InChI key：
YSSUBUNEGWFVMY-KNVOCYPGSA-N
SMILES：
O=C1O[C@@H]2CCCCC[C@@H]2O1
Systematic name (3)：
- (3aR,8aS)-ヘキサヒドロ-3aH-シクロヘプタ-1,3-ジオキソール-2-オン
- (3aR,8aS)-オクタヒドロシクロヘプタ[d][1,3]ジオキソール-2-オン
- (3aR,8aS)-octahydrocyclohepta[d][1,3]dioxol-2-one
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