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pyrido[2,3-d]pyrimidin-4(1H)-one, 5-(difluoromethyl)-1-(2,5-dimethylphenyl)-2-mercapto-7-phenyl-
SpectraBase Compound ID 6qcTaHmW2W3
InChI InChI=1S/C22H17F2N3OS/c1-12-8-9-13(2)17(10-12)27-20-18(21(28)26-22(27)29)15(19(23)24)11-16(25-20)14-6-4-3-5-7-14/h3-11,19H,1-2H3,(H,26,28,29)
InChIKey IPUCCVZBXKZVQJ-UHFFFAOYSA-N
Mol Weight 409.45 g/mol
Molecular Formula C22H17F2N3OS
Exact Mass 409.10604 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AAQHrhZZQ3C
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 5-(difluoromethyl)-1-(2,5-dimethylphenyl)-2-mercapto-7-phenyl-
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/C22H17F2N3OS/c1-12-8-9-13(2)17(10-12)27-20-18(21(28)26-22(27)29)15(19(23)24)11-16(25-20)14-6-4-3-5-7-14/h3-11,19H,1-2H3,(H,26,28,29)
InChIKey IPUCCVZBXKZVQJ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23309
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: 2278450; UZI_ID: UZI-023317
Temperature 308 °C