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4-(Difluoromethoxy)phenyl isothiocyanate

View entire compound with spectra: 2 NMR

4-(Difluoromethoxy)phenyl isothiocyanate
SpectraBase Compound ID 4NLNGo6q5kv
InChI InChI=1S/C8H5F2NOS/c9-8(10)12-7-3-1-6(2-4-7)11-5-13/h1-4,8H
InChIKey WSXQLHDOWYXTMQ-UHFFFAOYSA-N
Mol Weight 201.19 g/mol
Molecular Formula C8H5F2NOS
Exact Mass 201.005991 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AjUsvN9biJx
Name 4-(Difluoromethoxy)phenyl isothiocyanate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 525332
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H5F2NOS
InChI InChI=1S/C8H5F2NOS/c9-8(10)12-7-3-1-6(2-4-7)11-5-13/h1-4,8H
InChIKey WSXQLHDOWYXTMQ-UHFFFAOYSA-N
Molecular Weight 201.191 g/mol
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_015109