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pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(2-methoxyethyl)-7-methyl-5-(trifluoromethyl)-
SpectraBase Compound ID 6KHCorScPSh
InChI InChI=1S/C12H12F3N3O2S/c1-6-5-7(12(13,14)15)8-9(16-6)18(3-4-20-2)11(21)17-10(8)19/h5H,3-4H2,1-2H3,(H,17,19,21)
InChIKey VSPCAKPVVZAECT-UHFFFAOYSA-N
Mol Weight 319.3 g/mol
Molecular Formula C12H12F3N3O2S
Exact Mass 319.060232 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J0e7K6pGwJe
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(2-methoxyethyl)-7-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/C12H12F3N3O2S/c1-6-5-7(12(13,14)15)8-9(16-6)18(3-4-20-2)11(21)17-10(8)19/h5H,3-4H2,1-2H3,(H,17,19,21)
InChIKey VSPCAKPVVZAECT-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23690
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: 2283756; UZI_ID: UZI-023698
Temperature 308 °C