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5-[(1E)-2-cyano-3-(2-fluoroanilino)-3-oxo-1-propenyl]-2-methoxyphenyl benzoate
SpectraBase Compound ID F18ymqBVvmR
InChI InChI=1S/C24H17FN2O4/c1-30-21-12-11-16(14-22(21)31-24(29)17-7-3-2-4-8-17)13-18(15-26)23(28)27-20-10-6-5-9-19(20)25/h2-14H,1H3,(H,27,28)/b18-13+
InChIKey OUJCMPXATWLHLE-QGOAFFKASA-N
Mol Weight 416.41 g/mol
Molecular Formula C24H17FN2O4
Exact Mass 416.117235 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8HFpNW5t3ht
Name 5-[(1E)-2-cyano-3-(2-fluoroanilino)-3-oxo-1-propenyl]-2-methoxyphenyl benzoate
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/C24H17FN2O4/c1-30-21-12-11-16(14-22(21)31-24(29)17-7-3-2-4-8-17)13-18(15-26)23(28)27-20-10-6-5-9-19(20)25/h2-14H,1H3,(H,27,28)/b18-13+
InChIKey OUJCMPXATWLHLE-QGOAFFKASA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_2754
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/1009050; Labnumber: ARF3553; UZI_ID: UZI-002756
Synonyms 5-[2-cyano-3-(2-fluoroanilino)-3-oxo-1-propenyl]-2-methoxyphenyl benzoate
Temperature 315 °C