Chem
J-GLOBAL ID：200907002424560203
Nikkaji number：J1.655.994F
3-Methyl-4-(3-pyridinyl)-3-butene-2-one
3-メチル-4-(3-ピリジニル)-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： C10H11NO
Molecular formula furigana： C10-H11-N-O
Molecular weight： 161.204
InChI：
InChI=1S/C10H11NO/c1-8(9(2)12)6-10-4-3-5-11-7-10/h3-7H,1-2H3
InChI key：
NVCUBJGIRIYQQH-UHFFFAOYSA-N
SMILES：
CC(=O)C(=Cc1cccnc1)C
Systematic name (3)：
- 3-メチル-4-(3-ピリジニル)-3-ブテン-2-オン
- 3-メチル-4-(ピリジン-3-イル)ブタ-3-エン-2-オン
- 3-methyl-4-(pyridin-3-yl)but-3-en-2-one
- 3-Methyl-4-(3-pyridinyl)-3-butene-2-one
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