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3-Fluorophenyl isothiocyanate

View entire compound with spectra: 3 NMR, 5 FTIR, 1 Raman, and 2 MS (GC)

3-Fluorophenyl isothiocyanate
SpectraBase Compound ID DOrdAJREQT9
InChI InChI=1S/C7H4FNS/c8-6-2-1-3-7(4-6)9-5-10/h1-4H
InChIKey HDBACITVPQEAGG-UHFFFAOYSA-N
Mol Weight 153.17 g/mol
Molecular Formula C7H4FNS
Exact Mass 153.004848 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LJdMG2lqLY8
Name 3-Fluorophenyl isothiocyanate
Source of Sample Aldrich
Catalog Number F14351
CAS Registry Number 404-72-8
Classification Aromatic nitriles & cumulated double bonds
Copyright Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4FNS
InChI InChI=1S/C7H4FNS/c8-6-2-1-3-7(4-6)9-5-10/h1-4H
InChIKey HDBACITVPQEAGG-UHFFFAOYSA-N
Purity 99%
Source of Spectrum Sigma-Aldrich Co. LLC.
Technique Neat
Wiley ID SIAL_FTIR_1_9885