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-(2,3-dimethylphenyl)-2-mercapto-7-(1-methyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-
SpectraBase Compound ID DwiKOvmyyeF
InChI InChI=1S/C20H16F3N5OS/c1-10-5-4-6-15(11(10)2)28-17-16(18(29)26-19(28)30)13(20(21,22)23)7-14(25-17)12-8-24-27(3)9-12/h4-9H,1-3H3,(H,26,29,30)
InChIKey ZIJZXNPZLKRBJA-UHFFFAOYSA-N
Mol Weight 431.44 g/mol
Molecular Formula C20H16F3N5OS
Exact Mass 431.102766 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 Ls06VSqgDMe
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 1-(2,3-dimethylphenyl)-2-mercapto-7-(1-methyl-1H-pyrazol-4-yl)-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/C20H16F3N5OS/c1-10-5-4-6-15(11(10)2)28-17-16(18(29)26-19(28)30)13(20(21,22)23)7-14(25-17)12-8-24-27(3)9-12/h4-9H,1-3H3,(H,26,29,30)
InChIKey ZIJZXNPZLKRBJA-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21828
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: 2150638; UZI_ID: UZI-021836
Temperature 308 °C