Chem
J-GLOBAL ID：200907016227090778
Nikkaji number：J1.287.560F
4-(Isopropylthio)-3-butene-2-one
4-(イソプロピルチオ)-3-ブテン-2-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： C7H12OS
Molecular formula furigana： C7-H12-O-S
Molecular weight： 144.230
InChI：
InChI=1S/C7H12OS/c1-6(2)9-5-4-7(3)8/h4-6H,1-3H3
InChI key：
MMFXRBNVYLTOAB-UHFFFAOYSA-N
SMILES：
CC(C)SC=CC(=O)C
Systematic name (3)：
- 4-(イソプロピルチオ)-3-ブテン-2-オン
- 4-(プロパン-2-イルスルファニル)ブタ-3-エン-2-オン
- 4-(propan-2-ylsulfanyl)but-3-en-2-one
- 4-(Isopropylthio)-3-butene-2-one
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