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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(5-chloro-2-thienyl)-2-mercapto-1-methyl-5-(trifluoromethyl)-
SpectraBase Compound ID CVlTcUmhV30
InChI InChI=1S/C13H7ClF3N3OS2/c1-20-10-9(11(21)19-12(20)22)5(13(15,16)17)4-6(18-10)7-2-3-8(14)23-7/h2-4H,1H3,(H,19,21,22)
InChIKey ZNWJWDBJMJLDSU-UHFFFAOYSA-N
Mol Weight 377.79 g/mol
Molecular Formula C13H7ClF3N3OS2
Exact Mass 376.967116 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5JXVDfQCGxO
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(5-chloro-2-thienyl)-2-mercapto-1-methyl-5-(trifluoromethyl)-
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/C13H7ClF3N3OS2/c1-20-10-9(11(21)19-12(20)22)5(13(15,16)17)4-6(18-10)7-2-3-8(14)23-7/h2-4H,1H3,(H,19,21,22)
InChIKey ZNWJWDBJMJLDSU-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21892
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: 2176871; UZI_ID: UZI-021900
Temperature 308 °C