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4-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-2-furoyl}amino)benzoic acid
SpectraBase Compound ID 2hSvutu0dVS
InChI InChI=1S/C18H16ClN3O4/c1-10-16(19)11(2)22(21-10)9-14-7-8-15(26-14)17(23)20-13-5-3-12(4-6-13)18(24)25/h3-8H,9H2,1-2H3,(H,20,23)(H,24,25)
InChIKey OTKGWKVLYKLFET-UHFFFAOYSA-N
Mol Weight 373.8 g/mol
Molecular Formula C18H16ClN3O4
Exact Mass 373.082934 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Y6oAqZFZhA
Name 4-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-2-furoyl}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/C18H16ClN3O4/c1-10-16(19)11(2)22(21-10)9-14-7-8-15(26-14)17(23)20-13-5-3-12(4-6-13)18(24)25/h3-8H,9H2,1-2H3,(H,20,23)(H,24,25)
InChIKey OTKGWKVLYKLFET-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_3376
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/9146590; Labnumber: BAC_UAMK/009253; UZI_ID: UZI-003378
Temperature 318 °C