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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-ethyl-2-mercapto-1-(1-methylethyl)-5-(trifluoromethyl)-
SpectraBase Compound ID FYRM0fdoF6S
InChI InChI=1S/C13H14F3N3OS/c1-4-7-5-8(13(14,15)16)9-10(17-7)19(6(2)3)12(21)18-11(9)20/h5-6H,4H2,1-3H3,(H,18,20,21)
InChIKey KODWYXGXJXDVAI-UHFFFAOYSA-N
Mol Weight 317.33 g/mol
Molecular Formula C13H14F3N3OS
Exact Mass 317.080968 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5HmF5KB7C2Z
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 7-ethyl-2-mercapto-1-(1-methylethyl)-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/C13H14F3N3OS/c1-4-7-5-8(13(14,15)16)9-10(17-7)19(6(2)3)12(21)18-11(9)20/h5-6H,4H2,1-3H3,(H,18,20,21)
InChIKey KODWYXGXJXDVAI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23287
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: 2278366; UZI_ID: UZI-023295
Temperature 308 °C