Chem
J-GLOBAL ID：200907088915858974
Nikkaji number：J2.357.476D
(4aR)-5β,6β,9β-Metheno-4aα,6,9,9aα-tetrahydro-5H-benzocycloheptene
(4aR)-5β,6β,9β-メテノ-4aα,6,9,9aα-テトラヒドロ-5H-ベンゾシクロヘプテン
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： C12H12
Molecular formula furigana： C12-H12
Molecular weight： 156.228
InChI：
InChI=1S/C12H12/c1-2-4-8-7(3-1)9-5-6-10-11(8)12(9)10/h1-12H/t7-,8-,9-,10+,11+,12-/m1/s1
InChI key：
FSDZJZJZZKWLHP-UFVWWTPHSA-N
SMILES：
C1=C[C@H]2[C@@H]3[C@@H]1[C@@H]3[C@@H]1C=CC=C[C@@H]21
Systematic name (3)：
- (4aR)-5β,6β,9β-メテノ-4aα,6,9,9aα-テトラヒドロ-5H-ベンゾシクロヘプテン
- (1R,2S,4R,7R,8R)-テトラシクロ[6.4.0.02,4.03,7]ドデカ-5,9,11-トリエン
- (1R,2S,4R,7R,8R)-tetracyclo[6.4.0.02,4.03,7]dodeca-5,9,11-triene
- (4aR)-5β,6β,9β-Metheno-4aα,6,9,9aα-tetrahydro-5H-benzocycloheptene
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