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4-bromo-2-phenylsulfonylpyrazole-3-carboxylic acid

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4-bromo-2-phenylsulfonylpyrazole-3-carboxylic acid
SpectraBase Compound ID 7hoe70wRYLA
InChI InChI=1S/C10H7BrN2O4S/c11-8-6-12-13(9(8)10(14)15)18(16,17)7-4-2-1-3-5-7/h1-6H,(H,14,15)
InChIKey GOTDMWMMENPZQD-UHFFFAOYSA-N
Mol Weight 331.14 g/mol
Molecular Formula C10H7BrN2O4S
Exact Mass 329.930991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L971dXacsM4
Name 4-Bromo-1-phenylsulfonyl-pyrazole-5-carboxylic acid
Comments BRUKER AC 80 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H7BrN2O4S
InChI InChI=1S/C10H7BrN2O4S/c11-8-6-12-13(9(8)10(14)15)18(16,17)7-4-2-1-3-5-7/h1-6H,(H,14,15)
InChIKey GOTDMWMMENPZQD-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference G. Heinisch, W. Holzer, S.Pock, J. Chem. Soc. Perkin I 1829 (1990).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6