Chem
J-GLOBAL ID：201407097920669526
Nikkaji number：J3.220.914I
3-[1-(Methylthio)butyl]cyclohexanone
3-[1-(メチルチオ)ブチル]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： C11H20OS
Molecular formula furigana： C11-H20-O-S
Molecular weight： 200.340
InChI：
InChI=1S/C11H20OS/c1-3-5-11(13-2)9-6-4-7-10(12)8-9/h9,11H,3-8H2,1-2H3
InChI key：
NAXQQNHDTBGYDK-UHFFFAOYSA-N
SMILES：
CCCC(SC)C1CCCC(=O)C1
Systematic name (3)：
- 3-[1-(メチルチオ)ブチル]シクロヘキサノン
- 3-[1-(メチルスルファニル)ブチル]シクロヘキサン-1-オン
- 3-[1-(methylsulfanyl)butyl]cyclohexan-1-one
- 3-[1-(Methylthio)butyl]cyclohexanone
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