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(2Z)-3-[1-benzyl-3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-2-cyano-N-(2-fluorophenyl)-2-propenamide
SpectraBase Compound ID 5Mitqv3YJ6M
InChI InChI=1S/C27H21FN4O2/c1-34-23-13-11-20(12-14-23)26-22(18-32(31-26)17-19-7-3-2-4-8-19)15-21(16-29)27(33)30-25-10-6-5-9-24(25)28/h2-15,18H,17H2,1H3,(H,30,33)/b21-15-
InChIKey ILWVFONJXZYRFB-QNGOZBTKSA-N
Mol Weight 452.49 g/mol
Molecular Formula C27H21FN4O2
Exact Mass 452.164854 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GSehBWl3Isk
Name (2Z)-3-[1-benzyl-3-(4-methoxyphenyl)-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/C27H21FN4O2/c1-34-23-13-11-20(12-14-23)26-22(18-32(31-26)17-19-7-3-2-4-8-19)15-21(16-29)27(33)30-25-10-6-5-9-24(25)28/h2-15,18H,17H2,1H3,(H,30,33)/b21-15-
InChIKey ILWVFONJXZYRFB-QNGOZBTKSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7046
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/1267631; Labnumber: COL4076; UZI_ID: UZI-007048
Synonyms 3-[1-benzyl-3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-2-cyano-N-(2-fluorophenyl)-2-propenamide
Temperature 318 °C