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(2E)-3-[1-(4-chlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-2-cyano-N-(4-ethylphenyl)-2-propenamide
SpectraBase Compound ID 5lvv1NGzacj
InChI InChI=1S/C28H23ClN4O/c1-2-20-10-14-26(15-11-20)31-28(34)23(17-30)16-24-19-33(18-21-8-12-25(29)13-9-21)32-27(24)22-6-4-3-5-7-22/h3-16,19H,2,18H2,1H3,(H,31,34)/b23-16+
InChIKey MLSDGBWCXNIXGO-XQNSMLJCSA-N
Mol Weight 466.97 g/mol
Molecular Formula C28H23ClN4O
Exact Mass 466.156039 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AH5LkdFCbcb
Name (2E)-3-[1-(4-chlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-2-cyano-N-(4-ethylphenyl)-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/C28H23ClN4O/c1-2-20-10-14-26(15-11-20)31-28(34)23(17-30)16-24-19-33(18-21-8-12-25(29)13-9-21)32-27(24)22-6-4-3-5-7-22/h3-16,19H,2,18H2,1H3,(H,31,34)/b23-16+
InChIKey MLSDGBWCXNIXGO-XQNSMLJCSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7039
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/1266489; Labnumber: COL4065; UZI_ID: UZI-007041
Synonyms 3-[1-(4-chlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-2-cyano-N-(4-ethylphenyl)-2-propenamide
Temperature 318 °C