For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-pyridinecarboxylic acid, 2-(1-(cyanomethyl)-1,4-dihydro-2,4-dioxopyrido[2,3-d]pyrimidin-3(2H)-yl)-, methyl ester
SpectraBase Compound ID 7t4bO0Vpu9B
InChI InChI=1S/C16H11N5O4/c1-25-15(23)11-5-3-8-19-13(11)21-14(22)10-4-2-7-18-12(10)20(9-6-17)16(21)24/h2-5,7-8H,9H2,1H3
InChIKey RXHKLYPCVUMUHI-UHFFFAOYSA-N
Mol Weight 337.3 g/mol
Molecular Formula C16H11N5O4
Exact Mass 337.081104 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DG6RxM3zNv2
Name 3-pyridinecarboxylic acid, 2-(1-(cyanomethyl)-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 337.081103850 u
Formula C16H11N5O4
InChI InChI=1S/C16H11N5O4/c1-25-15(23)11-5-3-8-19-13(11)21-14(22)10-4-2-7-18-12(10)20(9-6-17)16(21)24/h2-5,7-8H,9H2,1H3
InChIKey RXHKLYPCVUMUHI-UHFFFAOYSA-N
Molecular Weight 337.295 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_994
Solvent DMSO-d6
Source Vendor ID: NMR/13239577