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pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(2-methoxyphenyl)-7-(3-methoxyphenyl)-5-(trifluoromethyl)-
SpectraBase Compound ID LM9zJeUF44h
InChI InChI=1S/C22H16F3N3O3S/c1-30-13-7-5-6-12(10-13)15-11-14(22(23,24)25)18-19(26-15)28(21(32)27-20(18)29)16-8-3-4-9-17(16)31-2/h3-11H,1-2H3,(H,27,29,32)
InChIKey WQAFSXTTYFXQOE-UHFFFAOYSA-N
Mol Weight 459.44 g/mol
Molecular Formula C22H16F3N3O3S
Exact Mass 459.086447 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LYmzze7CNBN
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(2-methoxyphenyl)-7-(3-methoxyphenyl)-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/C22H16F3N3O3S/c1-30-13-7-5-6-12(10-13)15-11-14(22(23,24)25)18-19(26-15)28(21(32)27-20(18)29)16-8-3-4-9-17(16)31-2/h3-11H,1-2H3,(H,27,29,32)
InChIKey WQAFSXTTYFXQOE-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23374
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: 2278730; UZI_ID: UZI-023382
Temperature 308 °C