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4-Fluorophenyl isothiocyanate

View entire compound with spectra: 6 NMR, 5 FTIR, 1 Raman, and 3 MS (GC)

4-Fluorophenyl isothiocyanate
SpectraBase Compound ID 3FoQCWdJ3R1
InChI InChI=1S/C7H4FNS/c8-6-1-3-7(4-2-6)9-5-10/h1-4H
InChIKey NFIUJHJMCQQYDL-UHFFFAOYSA-N
Mol Weight 153.17 g/mol
Molecular Formula C7H4FNS
Exact Mass 153.004848 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LNTHJIwBTbS
Name 4-Fluorophenyl isothiocyanate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 128406
CAS Registry Number 1544-68-9
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4FNS
InChI 1S/C7H4FNS/c8-6-1-3-7(4-2-6)9-5-10/h1-4H
InChIKey NFIUJHJMCQQYDL-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_000795