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2-pyrazinecarboxylic acid, 3-[[(5-chloro-2,4-dimethoxyphenyl)amino]carbonyl]-
SpectraBase Compound ID 9kBk60iL0R8
InChI InChI=1S/C14H12ClN3O5/c1-22-9-6-10(23-2)8(5-7(9)15)18-13(19)11-12(14(20)21)17-4-3-16-11/h3-6H,1-2H3,(H,18,19)(H,20,21)
InChIKey KQBHZPQAWXARGY-UHFFFAOYSA-N
Mol Weight 337.72 g/mol
Molecular Formula C14H12ClN3O5
Exact Mass 337.046548 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Frl3G21pRVD
Name 2-pyrazinecarboxylic acid, 3-[[(5-chloro-2,4-dimethoxyphenyl)amino]carbonyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 337.046548193 u
Formula C14H12ClN3O5
InChI InChI=1S/C14H12ClN3O5/c1-22-9-6-10(23-2)8(5-7(9)15)18-13(19)11-12(14(20)21)17-4-3-16-11/h3-6H,1-2H3,(H,18,19)(H,20,21)
InChIKey KQBHZPQAWXARGY-UHFFFAOYSA-N
Molecular Weight 337.719 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4987
Solvent DMSO-d6
Source Vendor ID: NMR/12708717