Chem
J-GLOBAL ID：200907085803740750
Nikkaji number：J582.687J
4-tert-Butyl-2-methylcyclohexanone
4-tert-ブチル-2-メチルシクロヘキサノン
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： C11H20O
Molecular formula furigana： C11-H20-O
Molecular weight： 168.280
InChI：
InChI=1S/C11H20O/c1-8-7-9(11(2,3)4)5-6-10(8)12/h8-9H,5-7H2,1-4H3
InChI key：
LYCRAZFAMQOPDJ-UHFFFAOYSA-N
SMILES：
CC1CC(CCC1=O)C(C)(C)C
Systematic name (3)：
- 4-tert-ブチル-2-メチルシクロヘキサノン
- 4-tert-ブチル-2-メチルシクロヘキサン-1-オン
- 4-tert-butyl-2-methylcyclohexan-1-one
- 4-tert-Butyl-2-methylcyclohexanone
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