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MDYVZAYZJOWUMA-UHFFFAOYSA-N
SpectraBase Compound ID JKQ5OaIIQ97
InChI InChI=1S/C16H13BrN2O2S/c17-15-12-19(22(20,21)14-9-5-2-6-10-14)18-16(15)11-13-7-3-1-4-8-13/h1-10,12H,11H2
InChIKey MDYVZAYZJOWUMA-UHFFFAOYSA-N
Mol Weight 377.26 g/mol
Molecular Formula C16H13BrN2O2S
Exact Mass 375.988112 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BMZnn9CrjbX
Name 3-Benzyl-4-bromo-1-phenylsulfonyl-pyrazole
Comments BRUKER AC 80 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H13BrN2O2S
InChI InChI=1S/C16H13BrN2O2S/c17-15-12-19(22(20,21)14-9-5-2-6-10-14)18-16(15)11-13-7-3-1-4-8-13/h1-10,12H,11H2
InChIKey MDYVZAYZJOWUMA-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