Chem
J-GLOBAL ID：200907097075865973
Nikkaji number：J1.115.445J
2-Nitro-3-methyl-2-butenenitrile
2-ニトロ-3-メチル-2-ブテンニトリル
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： C5H6N[N+]O[O-]
Molecular formula furigana： C5-H6-N2-O2
Molecular weight： 126.115
InChI：
InChI=1S/C5H6N2O2/c1-4(2)5(3-6)7(8)9/h1-2H3
InChI key：
BYIBCSLXUFXDLD-UHFFFAOYSA-N
SMILES：
CC(=C(C#N)[N+](=O)[O-])C
Systematic name (3)：
- 2-ニトロ-3-メチル-2-ブテンニトリル
- 3-メチル-2-ニトロブタ-2-エンニトリル
- 3-methyl-2-nitrobut-2-enenitrile
- 2-Nitro-3-methyl-2-butenenitrile
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