Chem
J-GLOBAL ID：200907074510399629   Nikkaji number：J2.367.382G

1-Methyl-1-phenylpentyl isothiocyanate

(2-イソチオシアナトヘキサン-2-イル)ベンゼン
Substance type：
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
Molecular formula： C13H17NS
Molecular formula furigana： C13-H17-N-S
Molecular weight： 219.350
InChI： InChI=1S/C13H17NS/c1-3-4-10-13(2,14-11-15)12-8-6-5-7-9-12/h5-9H,3-4,10H2,1-2H3
InChI key： JCCYQNQIFMIXLZ-UHFFFAOYSA-N
SMILES： CCCCC(C)(N=C=S)c1ccccc1
Systematic name  (3)：
  • 1-メチル-1-フェニルペンチルイソチオシアナート
  • (2-イソチオシアナトヘキサン-2-イル)ベンゼン
  • (2-isothiocyanatohexan-2-yl)benzene
Other name (1)：
  • 1-Methyl-1-phenylpentyl isothiocyanate
Thsaurus map：
Thesaurus Map

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