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(2Z)-3-[1-(4-chlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-2-cyano-N-(2-fluorophenyl)-2-propenamide
SpectraBase Compound ID Jg2LqjVtUdo
InChI InChI=1S/C26H18ClFN4O/c27-22-12-10-18(11-13-22)16-32-17-21(25(31-32)19-6-2-1-3-7-19)14-20(15-29)26(33)30-24-9-5-4-8-23(24)28/h1-14,17H,16H2,(H,30,33)/b20-14-
InChIKey LHOQLCCFLOPXCX-ZHZULCJRSA-N
Mol Weight 456.91 g/mol
Molecular Formula C26H18ClFN4O
Exact Mass 456.115317 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K1yDurMtj0U
Name (2Z)-3-[1-(4-chlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-2-cyano-N-(2-fluorophenyl)-2-propenamide
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/C26H18ClFN4O/c27-22-12-10-18(11-13-22)16-32-17-21(25(31-32)19-6-2-1-3-7-19)14-20(15-29)26(33)30-24-9-5-4-8-23(24)28/h1-14,17H,16H2,(H,30,33)/b20-14-
InChIKey LHOQLCCFLOPXCX-ZHZULCJRSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7053
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/1265870; Labnumber: COL4094; UZI_ID: UZI-007055
Synonyms 3-[1-(4-chlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-2-cyano-N-(2-fluorophenyl)-2-propenamide
Temperature 318 °C