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3-pyridinecarboxylic acid, 2-(1-[2-[(4-fluorophenyl)amino]-2-oxoethyl]-1,4-dihydro-2,4-dioxopyrido[2,3-d]pyrimidin-3(2H)-yl)-, methyl ester

View entire compound with spectra: 1 NMR

3-pyridinecarboxylic acid, 2-(1-[2-[(4-fluorophenyl)amino]-2-oxoethyl]-1,4-dihydro-2,4-dioxopyrido[2,3-d]pyrimidin-3(2H)-yl)-, methyl ester
SpectraBase Compound ID Jzs7PR01RAn
InChI InChI=1S/C22H16FN5O5/c1-33-21(31)16-5-3-11-25-19(16)28-20(30)15-4-2-10-24-18(15)27(22(28)32)12-17(29)26-14-8-6-13(23)7-9-14/h2-11H,12H2,1H3,(H,26,29)
InChIKey INXUABZQEVABMI-UHFFFAOYSA-N
Mol Weight 449.4 g/mol
Molecular Formula C22H16FN5O5
Exact Mass 449.113547 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I5OFV8hgEA0
Name 3-pyridinecarboxylic acid, 2-(1-[2-[(4-fluorophenyl)amino]-2-oxoethyl]-1,4-dihydro-2,4-dioxopyrido[2,3-d]pyrimidin-3(2H)-yl)-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 449.113546793 u
Formula C22H16FN5O5
InChI InChI=1S/C22H16FN5O5/c1-33-21(31)16-5-3-11-25-19(16)28-20(30)15-4-2-10-24-18(15)27(22(28)32)12-17(29)26-14-8-6-13(23)7-9-14/h2-11H,12H2,1H3,(H,26,29)
InChIKey INXUABZQEVABMI-UHFFFAOYSA-N
Molecular Weight 449.398 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1001
Solvent DMSO-d6
Source Vendor ID: NMR/13239585