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3-Bromo-4-fluorobenzoic acid

View entire compound with spectra: 4 NMR, 4 FTIR, 1 Raman, and 2 MS (GC)

3-Bromo-4-fluorobenzoic acid
SpectraBase Compound ID 4UtZ5QuUbUk
InChI InChI=1S/C7H4BrFO2/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3H,(H,10,11)
InChIKey ONELILMJNOWXSA-UHFFFAOYSA-N
Mol Weight 219.01 g/mol
Molecular Formula C7H4BrFO2
Exact Mass 217.937871 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DUpqRgeNHvU
Name 3-Bromo-4-fluorobenzoic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 341355
CAS Registry Number 1007-16-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4BrFO2
InChI InChI=1S/C7H4BrFO2/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3H,(H,10,11)
InChIKey ONELILMJNOWXSA-UHFFFAOYSA-N
Observed nucleus 13C
Purity 95%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_007052