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pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(2-methoxyphenyl)-7-(4-methylphenyl)-5-(trifluoromethyl)-
SpectraBase Compound ID Fj85LuYjDk8
InChI InChI=1S/C22H16F3N3O2S/c1-12-7-9-13(10-8-12)15-11-14(22(23,24)25)18-19(26-15)28(21(31)27-20(18)29)16-5-3-4-6-17(16)30-2/h3-11H,1-2H3,(H,27,29,31)
InChIKey NOQMGFOJOSUPJP-UHFFFAOYSA-N
Mol Weight 443.44 g/mol
Molecular Formula C22H16F3N3O2S
Exact Mass 443.091532 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1RY5fkK1hqj
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(2-methoxyphenyl)-7-(4-methylphenyl)-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/C22H16F3N3O2S/c1-12-7-9-13(10-8-12)15-11-14(22(23,24)25)18-19(26-15)28(21(31)27-20(18)29)16-5-3-4-6-17(16)30-2/h3-11H,1-2H3,(H,27,29,31)
InChIKey NOQMGFOJOSUPJP-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23316
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: 2278488; UZI_ID: UZI-023324
Temperature 308 °C