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4-[(1E)-3-anilino-2-cyano-3-oxo-1-propenyl]-2-chloro-6-ethoxyphenyl 4-methoxybenzoate
SpectraBase Compound ID 4CtLzHii7Sy
InChI InChI=1S/C26H21ClN2O5/c1-3-33-23-15-17(13-19(16-28)25(30)29-20-7-5-4-6-8-20)14-22(27)24(23)34-26(31)18-9-11-21(32-2)12-10-18/h4-15H,3H2,1-2H3,(H,29,30)/b19-13+
InChIKey LJITYVOIRQGPHG-CPNJWEJPSA-N
Mol Weight 476.92 g/mol
Molecular Formula C26H21ClN2O5
Exact Mass 476.113899 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4ZWPDAXT3PS
Name 4-[(1E)-3-anilino-2-cyano-3-oxo-1-propenyl]-2-chloro-6-ethoxyphenyl 4-methoxybenzoate
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/C26H21ClN2O5/c1-3-33-23-15-17(13-19(16-28)25(30)29-20-7-5-4-6-8-20)14-22(27)24(23)34-26(31)18-9-11-21(32-2)12-10-18/h4-15H,3H2,1-2H3,(H,29,30)/b19-13+
InChIKey LJITYVOIRQGPHG-CPNJWEJPSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8396
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: 9686519; UBI_ID: UBI-008399
Synonyms 4-[3-anilino-2-cyano-3-oxo-1-propenyl]-2-chloro-6-ethoxyphenyl 4-methoxybenzoate
Temperature 308 °C