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4-{[(4-chloro-5-nitro-1H-pyrazol-3-yl)carbonyl]amino}-1-methyl-1H-pyrazole-5-carboxylic acid
SpectraBase Compound ID 52UGltr2l4X
InChI InChI=1S/C9H7ClN6O5/c1-15-6(9(18)19)3(2-11-15)12-8(17)5-4(10)7(14-13-5)16(20)21/h2H,1H3,(H,12,17)(H,13,14)(H,18,19)
InChIKey BDPDXIOLGPJJIS-UHFFFAOYSA-N
Mol Weight 314.65 g/mol
Molecular Formula C9H7ClN6O5
Exact Mass 314.016645 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LLgZ2pTFOhY
Name 4-{[(4-chloro-5-nitro-1H-pyrazol-3-yl)carbonyl]amino}-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/C9H7ClN6O5/c1-15-6(9(18)19)3(2-11-15)12-8(17)5-4(10)7(14-13-5)16(20)21/h2H,1H3,(H,12,17)(H,13,14)(H,18,19)
InChIKey BDPDXIOLGPJJIS-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11142
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/1026402; Labnumber: MVY0351; UZI_ID: UZI-011144
Temperature 308 °C