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5-[(1E)-2-cyano-3-(2-fluoroanilino)-3-oxo-1-propenyl]-2-methoxyphenyl 4-methoxybenzoate
SpectraBase Compound ID GEqtzgJkqx7
InChI InChI=1S/C25H19FN2O5/c1-31-19-10-8-17(9-11-19)25(30)33-23-14-16(7-12-22(23)32-2)13-18(15-27)24(29)28-21-6-4-3-5-20(21)26/h3-14H,1-2H3,(H,28,29)/b18-13+
InChIKey YJKFEUXTHZOPKZ-QGOAFFKASA-N
Mol Weight 446.43 g/mol
Molecular Formula C25H19FN2O5
Exact Mass 446.1278 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GVLtJJEfRSA
Name 5-[(1E)-2-cyano-3-(2-fluoroanilino)-3-oxo-1-propenyl]-2-methoxyphenyl 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/C25H19FN2O5/c1-31-19-10-8-17(9-11-19)25(30)33-23-14-16(7-12-22(23)32-2)13-18(15-27)24(29)28-21-6-4-3-5-20(21)26/h3-14H,1-2H3,(H,28,29)/b18-13+
InChIKey YJKFEUXTHZOPKZ-QGOAFFKASA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_2755
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/1007858; Labnumber: ARF3555; UZI_ID: UZI-002757
Synonyms 5-[2-cyano-3-(2-fluoroanilino)-3-oxo-1-propenyl]-2-methoxyphenyl 4-methoxybenzoate
Temperature 315 °C