Chem
J-GLOBAL ID：200907038604730837
Nikkaji number：J1.055.668F
2-(Benzylthiomethyl)-2-butenenitrile
2-(ベンジルチオメチル)-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： C12H13NS
Molecular formula furigana： C12-H13-N-S
Molecular weight： 203.300
InChI：
InChI=1S/C12H13NS/c1-2-11(8-13)9-14-10-12-6-4-3-5-7-12/h2-7H,9-10H2,1H3
InChI key：
YKOGKOHRRMXRJT-UHFFFAOYSA-N
SMILES：
CC=C(CSCc1ccccc1)C#N
Systematic name (3)：
- 2-(ベンジルチオメチル)-2-ブテンニトリル
- 2-[(ベンジルスルファニル)メチル]ブタ-2-エンニトリル
- 2-[(benzylsulfanyl)methyl]but-2-enenitrile
- 2-(Benzylthiomethyl)-2-butenenitrile
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