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2-{[3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydro-2-pyridinyl]sulfanyl}-N-[2-(4-methoxyphenyl)ethyl]acetamide
SpectraBase Compound ID 5TX4JZVlQcS
InChI InChI=1S/C23H22FN3O3S/c1-30-16-8-6-15(7-9-16)10-11-26-22(29)14-31-23-19(13-25)18(12-21(28)27-23)17-4-2-3-5-20(17)24/h2-9,18H,10-12,14H2,1H3,(H,26,29)(H,27,28)
InChIKey OXAMCWVGUYSUNR-UHFFFAOYSA-N
Mol Weight 439.51 g/mol
Molecular Formula C23H22FN3O3S
Exact Mass 439.136591 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DOs7olc8Dk0
Name 2-{[3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydro-2-pyridinyl]sulfanyl}-N-[2-(4-methoxyphenyl)ethyl]acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 439.136590914 u
Formula C23H22FN3O3S
InChI InChI=1S/C23H22FN3O3S/c1-30-16-8-6-15(7-9-16)10-11-26-22(29)14-31-23-19(13-25)18(12-21(28)27-23)17-4-2-3-5-20(17)24/h2-9,18H,10-12,14H2,1H3,(H,26,29)(H,27,28)
InChIKey OXAMCWVGUYSUNR-UHFFFAOYSA-N
Molecular Weight 439.505 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1742
Solvent DMSO-d6
Source Vendor ID: NMR/12278334