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4-(Bromomethyl)benzoic acid

View entire compound with spectra: 6 NMR, 4 FTIR, 2 Raman, and 3 MS (GC)

4-(Bromomethyl)benzoic acid
SpectraBase Compound ID LHKDyGfh14c
InChI InChI=1S/C8H7BrO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,5H2,(H,10,11)
InChIKey CQQSQBRPAJSTFB-UHFFFAOYSA-N
Mol Weight 215.05 g/mol
Molecular Formula C8H7BrO2
Exact Mass 213.962942 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Dr9IEBbvx5t
Name 4-(bromomethyl)benzoic acid
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 213.962942463 u
Formula C8H7BrO2
InChI InChI=1S/C8H7BrO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,5H2,(H,10,11)
InChIKey CQQSQBRPAJSTFB-UHFFFAOYSA-N
Molecular Weight 215.046 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_3160
Solvent DMSO-d6
Source Vendor ID: NMR/12288512