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

*Links on SpectraBase are not permalinks.
pyrido[2,3-d]pyrimidin-4(1H)-one, 1-(2-ethoxyphenyl)-7-(4-fluorophenyl)-2-mercapto-5-(trifluoromethyl)-
SpectraBase Compound ID 2in0UwzRYO6
InChI InChI=1S/C22H15F4N3O2S/c1-2-31-17-6-4-3-5-16(17)29-19-18(20(30)28-21(29)32)14(22(24,25)26)11-15(27-19)12-7-9-13(23)10-8-12/h3-11H,2H2,1H3,(H,28,30,32)
InChIKey GHINBCMLOXVLBB-UHFFFAOYSA-N
Mol Weight 461.43 g/mol
Molecular Formula C22H15F4N3O2S
Exact Mass 461.082111 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 BAFkIiSSFX
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 1-(2-ethoxyphenyl)-7-(4-fluorophenyl)-2-mercapto-5-(trifluoromethyl)-
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/C22H15F4N3O2S/c1-2-31-17-6-4-3-5-16(17)29-19-18(20(30)28-21(29)32)14(22(24,25)26)11-15(27-19)12-7-9-13(23)10-8-12/h3-11H,2H2,1H3,(H,28,30,32)
InChIKey GHINBCMLOXVLBB-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23455
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: 2279098; UZI_ID: UZI-023463
Temperature 308 °C