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pyrido[2,3-d]pyrimidine-5-carboxylic acid, 1,4-dihydro-2-mercapto-1-(3-methylphenyl)-7-(3-nitrophenyl)-4-oxo-
SpectraBase Compound ID 4z8M8gRhVVN
InChI InChI=1S/C21H14N4O5S/c1-11-4-2-6-13(8-11)24-18-17(19(26)23-21(24)31)15(20(27)28)10-16(22-18)12-5-3-7-14(9-12)25(29)30/h2-10H,1H3,(H,27,28)(H,23,26,31)
InChIKey XKSXCDSBDZGTCF-UHFFFAOYSA-N
Mol Weight 434.43 g/mol
Molecular Formula C21H14N4O5S
Exact Mass 434.068491 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A1ZbO1DRG4D
Name pyrido[2,3-d]pyrimidine-5-carboxylic acid, 1,4-dihydro-2-mercapto-1-(3-methylphenyl)-7-(3-nitrophenyl)-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/C21H14N4O5S/c1-11-4-2-6-13(8-11)24-18-17(19(26)23-21(24)31)15(20(27)28)10-16(22-18)12-5-3-7-14(9-12)25(29)30/h2-10H,1H3,(H,27,28)(H,23,26,31)
InChIKey XKSXCDSBDZGTCF-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23607
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: 2283468; UZI_ID: UZI-023615
Temperature 308 °C