Chem
J-GLOBAL ID：201507015219562700
Nikkaji number：J3.423.012I
3-(Octylthio)-1-cyclohexanone
3-(オクチルチオ)-1-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： C14H26OS
Molecular formula furigana： C14-H26-O-S
Molecular weight： 242.420
InChI：
InChI=1S/C14H26OS/c1-2-3-4-5-6-7-11-16-14-10-8-9-13(15)12-14/h14H,2-12H2,1H3
InChI key：
SWEAJCUIMFJHJJ-UHFFFAOYSA-N
SMILES：
CCCCCCCCSC1CCCC(=O)C1
Systematic name (3)：
- 3-(オクチルチオ)-1-シクロヘキサノン
- 3-(オクチルスルファニル)シクロヘキサン-1-オン
- 3-(octylsulfanyl)cyclohexan-1-one
- 3-(Octylthio)-1-cyclohexanone
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