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pyrido[2,3-d]pyrimidine-5-carboxylic acid, 1,4-dihydro-2-mercapto-1-(3-methylphenyl)-7-(4-methylphenyl)-4-oxo-
SpectraBase Compound ID YRRl4LOkTH
InChI InChI=1S/C22H17N3O3S/c1-12-6-8-14(9-7-12)17-11-16(21(27)28)18-19(23-17)25(22(29)24-20(18)26)15-5-3-4-13(2)10-15/h3-11H,1-2H3,(H,27,28)(H,24,26,29)
InChIKey HIOWJFLYTSIRGR-UHFFFAOYSA-N
Mol Weight 403.46 g/mol
Molecular Formula C22H17N3O3S
Exact Mass 403.099063 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J4XMHBQwKmv
Name pyrido[2,3-d]pyrimidine-5-carboxylic acid, 1,4-dihydro-2-mercapto-1-(3-methylphenyl)-7-(4-methylphenyl)-4-oxo-
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/C22H17N3O3S/c1-12-6-8-14(9-7-12)17-11-16(21(27)28)18-19(23-17)25(22(29)24-20(18)26)15-5-3-4-13(2)10-15/h3-11H,1-2H3,(H,27,28)(H,24,26,29)
InChIKey HIOWJFLYTSIRGR-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23560
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: 2283279; UZI_ID: UZI-023568
Temperature 308 °C