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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(5-ethyl-2-thienyl)-2-mercapto-1-(3-methoxypropyl)-5-(trifluoromethyl)-
SpectraBase Compound ID E0l7hqDBkDR
InChI InChI=1S/C18H18F3N3O2S2/c1-3-10-5-6-13(28-10)12-9-11(18(19,20)21)14-15(22-12)24(7-4-8-26-2)17(27)23-16(14)25/h5-6,9H,3-4,7-8H2,1-2H3,(H,23,25,27)
InChIKey KMAPDJTXGMXJKI-UHFFFAOYSA-N
Mol Weight 429.48 g/mol
Molecular Formula C18H18F3N3O2S2
Exact Mass 429.079254 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BdsczIfXCaZ
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(5-ethyl-2-thienyl)-2-mercapto-1-(3-methoxypropyl)-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/C18H18F3N3O2S2/c1-3-10-5-6-13(28-10)12-9-11(18(19,20)21)14-15(22-12)24(7-4-8-26-2)17(27)23-16(14)25/h5-6,9H,3-4,7-8H2,1-2H3,(H,23,25,27)
InChIKey KMAPDJTXGMXJKI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21866
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent ACETONE-d6
Source File Reference VendorID: 2166546; UZI_ID: UZI-021874
Temperature 308 °C