Chem
J-GLOBAL ID：200907065572321368
Nikkaji number：J1.364.893J
3,3-Diallyl-3aα,4,7,7aα-tetrahydroisobenzofuran-1(3H)-one
3,3-ジアリル-3aα,4,7,7aα-テトラヒドロイソベンゾフラン-1(3H)-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： C14H18O2
Molecular formula furigana： C14-H18-O2
Molecular weight： 218.296
InChI：
InChI=1S/C14H18O2/c1-3-9-14(10-4-2)12-8-6-5-7-11(12)13(15)16-14/h3-6,11-12H,1-2,7-10H2/t11-,12+/m1/s1
InChI key：
BWSBNRQEXLRAKC-NEPJUHHUSA-N
SMILES：
C=CCC1(CC=C)OC(=O)[C@@H]2CC=CC[C@H]12
Systematic name (3)：
- 3,3-ジアリル-3aα,4,7,7aα-テトラヒドロイソベンゾフラン-1(3H)-オン
- (3aS,7aR)-3,3-ビス(プロパ-2-エン-1-イル)-1,3,3a,4,7,7a-ヘキサヒドロ-2-ベンゾフラン-1-オン
- (3aS,7aR)-3,3-bis(prop-2-en-1-yl)-1,3,3a,4,7,7a-hexahydro-2-benzofuran-1-one
- 3,3-Diallyl-3aα,4,7,7aα-tetrahydroisobenzofuran-1(3H)-one
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