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3-{[(4-bromo-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoic acid
SpectraBase Compound ID L2yp9YT36cj
InChI InChI=1S/C13H12BrN3O3/c1-2-17-11(10(14)7-15-17)12(18)16-9-5-3-4-8(6-9)13(19)20/h3-7H,2H2,1H3,(H,16,18)(H,19,20)
InChIKey HOOZBXQFLLVECE-UHFFFAOYSA-N
Mol Weight 338.16 g/mol
Molecular Formula C13H12BrN3O3
Exact Mass 337.006204 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6ZEuMceK9JK
Name 3-{[(4-bromo-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}benzoic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H12BrN3O3/c1-2-17-11(10(14)7-15-17)12(18)16-9-5-3-4-8(6-9)13(19)20/h3-7H,2H2,1H3,(H,16,18)(H,19,20)
InChIKey HOOZBXQFLLVECE-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4584
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 9284578; UBI_ID: UBI-004585
Temperature 313 °C