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pyrido[2,3-d]pyrimidine-5-carboxylic acid, 7-(4-chlorophenyl)-1,4-dihydro-2-mercapto-1-methyl-4-oxo-, methyl ester
SpectraBase Compound ID Koz8rJsL18M
InChI InChI=1S/C16H12ClN3O3S/c1-20-13-12(14(21)19-16(20)24)10(15(22)23-2)7-11(18-13)8-3-5-9(17)6-4-8/h3-7H,1-2H3,(H,19,21,24)
InChIKey VKLLMZOTHJBWRY-UHFFFAOYSA-N
Mol Weight 361.8 g/mol
Molecular Formula C16H12ClN3O3S
Exact Mass 361.02879 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1orLCvMbJzy
Name pyrido[2,3-d]pyrimidine-5-carboxylic acid, 7-(4-chlorophenyl)-1,4-dihydro-2-mercapto-1-methyl-4-oxo-, methyl ester
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/C16H12ClN3O3S/c1-20-13-12(14(21)19-16(20)24)10(15(22)23-2)7-11(18-13)8-3-5-9(17)6-4-8/h3-7H,1-2H3,(H,19,21,24)
InChIKey VKLLMZOTHJBWRY-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21863
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: 2165685; UZI_ID: UZI-021871
Temperature 308 °C