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acetamide, 2-[[3-cyano-4-(4-fluorophenyl)-1,4,5,6-tetrahydro-6-oxo-2-pyridinyl]thio]-N-(4-ethoxyphenyl)-
SpectraBase Compound ID JHKyOo9QyOo
InChI InChI=1S/C22H20FN3O3S/c1-2-29-17-9-7-16(8-10-17)25-21(28)13-30-22-19(12-24)18(11-20(27)26-22)14-3-5-15(23)6-4-14/h3-10,18H,2,11,13H2,1H3,(H,25,28)(H,26,27)
InChIKey MXLWDOSNYCQROU-UHFFFAOYSA-N
Mol Weight 425.48 g/mol
Molecular Formula C22H20FN3O3S
Exact Mass 425.120941 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FJvzbF1Jy3C
Name acetamide, 2-[[3-cyano-4-(4-fluorophenyl)-1,4,5,6-tetrahydro-6-oxo-2-pyridinyl]thio]-N-(4-ethoxyphenyl)-
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/C22H20FN3O3S/c1-2-29-17-9-7-16(8-10-17)25-21(28)13-30-22-19(12-24)18(11-20(27)26-22)14-3-5-15(23)6-4-14/h3-10,18H,2,11,13H2,1H3,(H,25,28)(H,26,27)
InChIKey MXLWDOSNYCQROU-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2219
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/11238513