Chem
J-GLOBAL ID：201907004696780555
Nikkaji number：J3.737.027D
4-メチル-4-(1,3-ジチアン-2-イル)ペンタン-2-オン
4-メチル-4-(1,3-ジチアン-2-イル)ペンタン-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： C10H18OS2
Molecular formula furigana： C10-H18-O-S2
Molecular weight： 218.370
InChI：
InChI=1S/C10H18OS2/c1-8(11)7-10(2,3)9-12-5-4-6-13-9/h9H,4-7H2,1-3H3
InChI key：
LJDMQLWZSLRBHO-UHFFFAOYSA-N
SMILES：
CC(=O)CC(C)(C1SCCCS1)C
Systematic name (3)：
- 4-メチル-4-(1,3-ジチアン-2-イル)ペンタン-2-オン
- 4-(1,3-ジチアン-2-イル)-4-メチルペンタン-2-オン
- 4-(1,3-dithian-2-yl)-4-methylpentan-2-one
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