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pyrido[2,3-d]pyrimidine-5-carboxylic acid, 1-butyl-1,4-dihydro-2-mercapto-7-(4-methylphenyl)-4-oxo-, methyl ester
SpectraBase Compound ID 47u7sbTk4B0
InChI InChI=1S/C20H21N3O3S/c1-4-5-10-23-17-16(18(24)22-20(23)27)14(19(25)26-3)11-15(21-17)13-8-6-12(2)7-9-13/h6-9,11H,4-5,10H2,1-3H3,(H,22,24,27)
InChIKey XEAYEALSDGMULA-UHFFFAOYSA-N
Mol Weight 383.47 g/mol
Molecular Formula C20H21N3O3S
Exact Mass 383.130363 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CYike6jR7eq
Name pyrido[2,3-d]pyrimidine-5-carboxylic acid, 1-butyl-1,4-dihydro-2-mercapto-7-(4-methylphenyl)-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/C20H21N3O3S/c1-4-5-10-23-17-16(18(24)22-20(23)27)14(19(25)26-3)11-15(21-17)13-8-6-12(2)7-9-13/h6-9,11H,4-5,10H2,1-3H3,(H,22,24,27)
InChIKey XEAYEALSDGMULA-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21810
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: 2141330; UZI_ID: UZI-021818
Temperature 308 °C