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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-[4-(1,1-dimethylethyl)phenyl]-2-mercapto-1-(2-methoxyphenyl)-5-(trifluoromethyl)-
SpectraBase Compound ID G9TGMgteoJK
InChI InChI=1S/C25H22F3N3O2S/c1-24(2,3)15-11-9-14(10-12-15)17-13-16(25(26,27)28)20-21(29-17)31(23(34)30-22(20)32)18-7-5-6-8-19(18)33-4/h5-13H,1-4H3,(H,30,32,34)
InChIKey WATUDEIMPGZIPA-UHFFFAOYSA-N
Mol Weight 485.53 g/mol
Molecular Formula C25H22F3N3O2S
Exact Mass 485.138483 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6TaFlP1yyHh
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 7-[4-(1,1-dimethylethyl)phenyl]-2-mercapto-1-(2-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/C25H22F3N3O2S/c1-24(2,3)15-11-9-14(10-12-15)17-13-16(25(26,27)28)20-21(29-17)31(23(34)30-22(20)32)18-7-5-6-8-19(18)33-4/h5-13H,1-4H3,(H,30,32,34)
InChIKey WATUDEIMPGZIPA-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23321
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: 2278508; UZI_ID: UZI-023329
Temperature 308 °C