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2-Bromothioanisole

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

2-Bromothioanisole
SpectraBase Compound ID L6i02pByD1c
InChI InChI=1S/C7H7BrS/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3
InChIKey ALAQDUSTXPEHMH-UHFFFAOYSA-N
Mol Weight 203.1 g/mol
Molecular Formula C7H7BrS
Exact Mass 201.945184 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EWOoR1uj7G
Name 2-Bromothioanisole
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 260851
CAS Registry Number 19614-16-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7BrS
InChI InChI=1S/C7H7BrS/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3
InChIKey ALAQDUSTXPEHMH-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 2-Bromophenyl methyl sulfide
Wiley ID SIAL_13CNMR_004660