Chem
J-GLOBAL ID：200907021764035612
Nikkaji number：J540.033C
(3aα,7aα)-Octahydroisobenzofuran-1-one
(3aα,7aα)-オクタヒドロイソベンゾフラン-1-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： C8H12O2
Molecular formula furigana： C8-H12-O2
Molecular weight： 140.182
InChI：
InChI=1S/C8H12O2/c9-8-7-4-2-1-3-6(7)5-10-8/h6-7H,1-5H2/t6-,7-/m1/s1
InChI key：
WLYUMBPDHPMKHM-RNFRBKRXSA-N
SMILES：
O=C1OC[C@H]2CCCC[C@@H]12
Systematic name (14)：
- (3aα,7aα)-ヘキサヒドロイソベンゾフラン-1(3H)-オン
- (3aα,7aα)-ヘキサヒドロ-1(3H)-イソベンゾフラノン
- 3aα,4,5,6,7,7aα-ヘキサヒドロイソベンゾフラン-1(3H)-オン
- (3aS,7aR)-3a,4,5,6,7,7a-ヘキサヒドロイソベンゾフラン-1(3H)-オン
- (1α,6α)-8-オキサビシクロ[4.3.0]ノナン-7-オン
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- (3aα,7aα)-Hexahydro-1(3H)-isobenzofuranone
- 3aα,4,5,6,7,7aα-Hexahydroisobenzofuran-1(3H)-one
- (3aS,7aR)-3a,4,5,6,7,7a-Hexahydroisobenzofuran-1(3H)-one
- (1α,6α)-8-Oxabicyclo[4.3.0]nonane-7-one
- 2β-Hydroxymethylcyclohexane-1β-carboxylic acid lactone
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