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acetamide, 2-[[3-cyano-4-(2-ethoxyphenyl)-1,4,5,6-tetrahydro-6-oxo-2-pyridinyl]thio]-N-(3-fluorophenyl)-
SpectraBase Compound ID BjtGrLoVGN3
InChI InChI=1S/C22H20FN3O3S/c1-2-29-19-9-4-3-8-16(19)17-11-20(27)26-22(18(17)12-24)30-13-21(28)25-15-7-5-6-14(23)10-15/h3-10,17H,2,11,13H2,1H3,(H,25,28)(H,26,27)
InChIKey UGLDUQIDAZELSB-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 26yxMdFx4LU
Name acetamide, 2-[[3-cyano-4-(2-ethoxyphenyl)-1,4,5,6-tetrahydro-6-oxo-2-pyridinyl]thio]-N-(3-fluorophenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 425.120940850 u
Formula C22H20FN3O3S
InChI InChI=1S/C22H20FN3O3S/c1-2-29-19-9-4-3-8-16(19)17-11-20(27)26-22(18(17)12-24)30-13-21(28)25-15-7-5-6-14(23)10-15/h3-10,17H,2,11,13H2,1H3,(H,25,28)(H,26,27)
InChIKey UGLDUQIDAZELSB-UHFFFAOYSA-N
Molecular Weight 425.478 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7745
Solvent DMSO-d6
Source Vendor ID: NMR/10231961; Lab Info: KR; Lab Number: KR-KC03607
Temperature 23.85 °C