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(2E)-3-{2-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}-2-cyano-N-[2-(trifluoromethyl)phenyl]-2-propenamide
SpectraBase Compound ID DMZT8f3soXI
InChI InChI=1S/C25H18ClF3N2O3/c1-33-22-12-6-8-16(23(22)34-15-17-7-2-4-10-20(17)26)13-18(14-30)24(32)31-21-11-5-3-9-19(21)25(27,28)29/h2-13H,15H2,1H3,(H,31,32)/b18-13+
InChIKey CKWGXKSRVGTSHO-QGOAFFKASA-N
Mol Weight 486.88 g/mol
Molecular Formula C25H18ClF3N2O3
Exact Mass 486.095805 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8DqGueFDJFE
Name (2E)-3-{2-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}-2-cyano-N-[2-(trifluoromethyl)phenyl]-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/C25H18ClF3N2O3/c1-33-22-12-6-8-16(23(22)34-15-17-7-2-4-10-20(17)26)13-18(14-30)24(32)31-21-11-5-3-9-19(21)25(27,28)29/h2-13H,15H2,1H3,(H,31,32)/b18-13+
InChIKey CKWGXKSRVGTSHO-QGOAFFKASA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_2704
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/1007696; Labnumber: ARF3151; UZI_ID: UZI-002706
Synonyms 3-{2-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}-2-cyano-N-[2-(trifluoromethyl)phenyl]-2-propenamide
Temperature 308 °C