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3-[(4-chloro-2-fluoroanilino)carbonyl]-1-methyl-1H-pyrazole-5-carboxylic acid
SpectraBase Compound ID 3o14rDDBEfK
InChI InChI=1S/C12H9ClFN3O3/c1-17-10(12(19)20)5-9(16-17)11(18)15-8-3-2-6(13)4-7(8)14/h2-5H,1H3,(H,15,18)(H,19,20)
InChIKey BIGGZBJFNJBJQE-UHFFFAOYSA-N
Mol Weight 297.67 g/mol
Molecular Formula C12H9ClFN3O3
Exact Mass 297.031647 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G77ILp8NV3U
Name 3-[(4-chloro-2-fluoroanilino)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/C12H9ClFN3O3/c1-17-10(12(19)20)5-9(16-17)11(18)15-8-3-2-6(13)4-7(8)14/h2-5H,1H3,(H,15,18)(H,19,20)
InChIKey BIGGZBJFNJBJQE-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_3300
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/9143695; Labnumber: BAC_UAMK/006931; UZI_ID: UZI-003302
Temperature 308 °C