For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2,6-Dimethylphenyl isothiocyanate
SpectraBase Compound ID 3oYdd9DyWuq
InChI InChI=1S/C9H9NS/c1-7-4-3-5-8(2)9(7)10-6-11/h3-5H,1-2H3
InChIKey UULUECCNPPJFBU-UHFFFAOYSA-N
Mol Weight 163.24 g/mol
Molecular Formula C9H9NS
Exact Mass 163.04557 g/mol
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum AC-1984-206-0
  • Benzene, 2-isothiocyanato-1,3-dimethyl-
  • 2,6-Xylyl isothiocyanate
  • 2,6-Dimethylphenyl-1-isothiocyanate
  • Isothiocyanic acid, 2,6-xylyl ester
  • 2-Isothiocyanato-1,3-dimethylbenzene
  • EINECS 242-906-0

This compound is available in the following databases:

KnowItAll Mass Spectral Library

Author: Wiley

The KnowItAll Mass Spectral Library offers a comprehensive collection of mass spectra, including the renowned Wiley Registry, and access to a wide range of compounds including pure organics, drugs, steroids, additives, geochemicals, petrochemicals, biomarkers, and more. Learn more.

Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.