Chem
J-GLOBAL ID：201607014133581738
Nikkaji number：J3.461.896H
4-Oxo-6-methyl-7-octenenitrile
4-オキソ-6-メチル-7-オクテンニトリル
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： C9H13NO
Molecular formula furigana： C9-H13-N-O
Molecular weight： 151.209
InChI：
InChI=1S/C9H13NO/c1-3-8(2)7-9(11)5-4-6-10/h3,8H,1,4-5,7H2,2H3
InChI key：
GNOHLXCPSHKUAS-UHFFFAOYSA-N
SMILES：
CC(CC(=O)CCC#N)C=C
Systematic name (3)：
- 4-オキソ-6-メチル-7-オクテンニトリル
- 6-メチル-4-オキソオクタ-7-エンニトリル
- 6-methyl-4-oxooct-7-enenitrile
- 4-Oxo-6-methyl-7-octenenitrile
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