Chem
J-GLOBAL ID：200907021799947886   Nikkaji number：J385.656I

FEMA-4415

6-メチルチオヘキシルからし油
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： C8H15NS2
Molecular formula furigana： C8-H15-N-S2
Molecular weight： 189.340
InChI： InChI=1S/C8H15NS2/c1-11-7-5-3-2-4-6-9-8-10/h2-7H2,1H3
InChI key： YIBXPFAXPUDDTK-UHFFFAOYSA-N
SMILES： CSCCCCCCN=C=S
Systematic name  (4)：
  • 6-(メチルチオ)ヘキシルイソチオシアナート
  • 6-メチルチオヘキシルイソチオシアナート
  • 1-イソチオシアナト-6-(メチルチオ)ヘキサン
  • 1-isothiocyanato-6-(methylsulfanyl)hexane
Other name (8)：
  • 6-Methylthiohexyl isothiocyanate
  • 6-メチルチオヘキシルからし油
  • 6-Methylthiohexyl mustard oil
  • 6-(Methylthio)hexyl isothiocyanate
  • FEMA-4415
Show all
CAS registry number： 4430-39-1
Regulation number (1)：
  • 2-(11)-90
Thsaurus map：
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