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-cyclopentyl-5-(difluoromethyl)-7-(3,4-dimethylphenyl)-2-mercapto-
SpectraBase Compound ID 7ZneWN37SwL
InChI InChI=1S/C21H21F2N3OS/c1-11-7-8-13(9-12(11)2)16-10-15(18(22)23)17-19(24-16)26(14-5-3-4-6-14)21(28)25-20(17)27/h7-10,14,18H,3-6H2,1-2H3,(H,25,27,28)
InChIKey JBVDAAUBOVCHOK-UHFFFAOYSA-N
Mol Weight 401.48 g/mol
Molecular Formula C21H21F2N3OS
Exact Mass 401.13734 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 GWnKswniOTd
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 1-cyclopentyl-5-(difluoromethyl)-7-(3,4-dimethylphenyl)-2-mercapto-
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/C21H21F2N3OS/c1-11-7-8-13(9-12(11)2)16-10-15(18(22)23)17-19(24-16)26(14-5-3-4-6-14)21(28)25-20(17)27/h7-10,14,18H,3-6H2,1-2H3,(H,25,27,28)
InChIKey JBVDAAUBOVCHOK-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23495
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: 2279262; UZI_ID: UZI-023503
Temperature 308 °C