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methyl (2E)-3-(3-chloro-4-fluoroanilino)-2-cyano-4,4,4-trifluoro-2-butenoate

View entire compound with spectra: 1 NMR

methyl (2E)-3-(3-chloro-4-fluoroanilino)-2-cyano-4,4,4-trifluoro-2-butenoate
SpectraBase Compound ID 5osx1qcHcRz
InChI InChI=1S/C12H7ClF4N2O2/c1-21-11(20)7(5-18)10(12(15,16)17)19-6-2-3-9(14)8(13)4-6/h2-4,19H,1H3/b10-7+
InChIKey RAYNIKPBKYEAGZ-JXMROGBWSA-N
Mol Weight 322.65 g/mol
Molecular Formula C12H7ClF4N2O2
Exact Mass 322.013218 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CHCYnconVIh
Name methyl (2E)-3-(3-chloro-4-fluoroanilino)-2-cyano-4,4,4-trifluoro-2-butenoate
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/C12H7ClF4N2O2/c1-21-11(20)7(5-18)10(12(15,16)17)19-6-2-3-9(14)8(13)4-6/h2-4,19H,1H3/b10-7+
InChIKey RAYNIKPBKYEAGZ-JXMROGBWSA-N
NMR Offset 13.9804
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_1785
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: NMR/9254012; Labnumber: AU-0000928
Temperature 297 °C