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XQACWEBGSZBLRG-UHFFFAOYSA-N

View entire compound with spectra: 6 NMR, and 5 FTIR

XQACWEBGSZBLRG-UHFFFAOYSA-N
SpectraBase Compound ID JX1Nx7GP4jh
InChI InChI=1S/C7H4BrNS/c8-6-1-3-7(4-2-6)9-5-10/h1-4H
InChIKey XQACWEBGSZBLRG-UHFFFAOYSA-N
Mol Weight 214.08 g/mol
Molecular Formula C7H4BrNS
Exact Mass 212.924783 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DEw6BRt4MtL
Name 4-Bromophenyl isothiocyanate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 270202
CAS Registry Number 1985-12-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4BrNS
InChI InChI=1S/C7H4BrNS/c8-6-1-3-7(4-2-6)9-5-10/h1-4H
InChIKey XQACWEBGSZBLRG-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_004901