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3-Bromo-2,6-dihydroxy-4-methyl-benzoic acid, methyl ester
SpectraBase Compound ID HEUJHbmsnr0
InChI InChI=1S/C9H9BrO4/c1-4-3-5(11)6(9(13)14-2)8(12)7(4)10/h3,11-12H,1-2H3
InChIKey VNFPROZUUVJTKD-UHFFFAOYSA-N
Mol Weight 261.07 g/mol
Molecular Formula C9H9BrO4
Exact Mass 259.968422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JfxVOLTHBMZ
Name 3-Bromo-2,6-dihydroxy-4-methyl-benzoic acid, methyl ester
CAS Registry Number 120915-41-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H9BrO4
InChI InChI=1S/C9H9BrO4/c1-4-3-5(11)6(9(13)14-2)8(12)7(4)10/h3,11-12H,1-2H3
InChIKey VNFPROZUUVJTKD-UHFFFAOYSA-N
Instrument Name Bruker AC-250
Literature Reference P.E. Hansen, Acta Chem. Scand. B42, 423 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3