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3-{[(2-chlorobenzyl)amino]carbonyl}-1-methyl-1H-pyrazole-5-carboxylic acid
SpectraBase Compound ID GyhcIkRTAqM
InChI InChI=1S/C13H12ClN3O3/c1-17-11(13(19)20)6-10(16-17)12(18)15-7-8-4-2-3-5-9(8)14/h2-6H,7H2,1H3,(H,15,18)(H,19,20)
InChIKey ZQDQYACDLQBZEO-UHFFFAOYSA-N
Mol Weight 293.71 g/mol
Molecular Formula C13H12ClN3O3
Exact Mass 293.056719 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HuaUxQhfhr3
Name 3-{[(2-chlorobenzyl)amino]carbonyl}-1-methyl-1H-pyrazole-5-carboxylic 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/C13H12ClN3O3/c1-17-11(13(19)20)6-10(16-17)12(18)15-7-8-4-2-3-5-9(8)14/h2-6H,7H2,1H3,(H,15,18)(H,19,20)
InChIKey ZQDQYACDLQBZEO-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_3640
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: UZI/9232438; Labnumber: BAC_UAMK/014815; UZI_ID: UZI-003642
Temperature 308 °C