Chem
J-GLOBAL ID：200907058559063175
Nikkaji number：J672.973H
3-Phenyl-4-oxopentanenitrile
3-フェニル-4-オキソペンタンニトリル
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： C11H11NO
Molecular formula furigana： C11-H11-N-O
Molecular weight： 173.215
InChI：
InChI=1S/C11H11NO/c1-9(13)11(7-8-12)10-5-3-2-4-6-10/h2-6,11H,7H2,1H3
InChI key：
JJJRQDLYKDBUMU-UHFFFAOYSA-N
SMILES：
CC(=O)C(CC#N)c1ccccc1
Systematic name (3)：
- 3-フェニル-4-オキソペンタンニトリル
- 4-オキソ-3-フェニルペンタンニトリル
- 4-oxo-3-phenylpentanenitrile
- 3-Phenyl-4-oxopentanenitrile
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