Chem
J-GLOBAL ID：200907001773942494
Nikkaji number：J2.130.174D
(3aR)-5,5-Dimethoxy-7aβ-methyloctahydro-1H-indene-1-one
(3aR)-5,5-ジメトキシ-7aβ-メチルオクタヒドロ-1H-インデン-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： C12H20O3
Molecular formula furigana： C12-H20-O3
Molecular weight： 212.289
InChI：
InChI=1S/C12H20O3/c1-11-6-7-12(14-2,15-3)8-9(11)4-5-10(11)13/h9H,4-8H2,1-3H3/t9-,11+/m1/s1
InChI key：
UMNLLQOCPUZBJC-KOLCDFICSA-N
SMILES：
COC1(CC[C@@]2(C)[C@H](CCC2=O)C1)OC
Systematic name (3)：
- (3aR)-5,5-ジメトキシ-7aβ-メチルオクタヒドロ-1H-インデン-1-オン
- (3aR,7aS)-5,5-ジメトキシ-7a-メチル-オクタヒドロ-1H-インデン-1-オン
- (3aR,7aS)-5,5-dimethoxy-7a-methyl-octahydro-1H-inden-1-one
- (3aR)-5,5-Dimethoxy-7aβ-methyloctahydro-1H-indene-1-one
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