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pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(2-methoxyethyl)-7-(5-methyl-2-thienyl)-5-(trifluoromethyl)-
SpectraBase Compound ID 6InHX41QHpF
InChI InChI=1S/C16H14F3N3O2S2/c1-8-3-4-11(26-8)10-7-9(16(17,18)19)12-13(20-10)22(5-6-24-2)15(25)21-14(12)23/h3-4,7H,5-6H2,1-2H3,(H,21,23,25)
InChIKey IJVRAEUYZARTFC-UHFFFAOYSA-N
Mol Weight 401.42 g/mol
Molecular Formula C16H14F3N3O2S2
Exact Mass 401.047954 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KGKPiiniQpi
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(2-methoxyethyl)-7-(5-methyl-2-thienyl)-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/C16H14F3N3O2S2/c1-8-3-4-11(26-8)10-7-9(16(17,18)19)12-13(20-10)22(5-6-24-2)15(25)21-14(12)23/h3-4,7H,5-6H2,1-2H3,(H,21,23,25)
InChIKey IJVRAEUYZARTFC-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23658
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: 2283634; UZI_ID: UZI-023666
Temperature 308 °C