For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(3-methoxypropyl)-7-(5-methyl-2-thienyl)-5-(trifluoromethyl)-
SpectraBase Compound ID 8zGeC6DzvGN
InChI InChI=1S/C17H16F3N3O2S2/c1-9-4-5-12(27-9)11-8-10(17(18,19)20)13-14(21-11)23(6-3-7-25-2)16(26)22-15(13)24/h4-5,8H,3,6-7H2,1-2H3,(H,22,24,26)
InChIKey DSZYYSWIZONTAV-UHFFFAOYSA-N
Mol Weight 415.45 g/mol
Molecular Formula C17H16F3N3O2S2
Exact Mass 415.063604 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EsEGYqXYfm4
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(3-methoxypropyl)-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/C17H16F3N3O2S2/c1-9-4-5-12(27-9)11-8-10(17(18,19)20)13-14(21-11)23(6-3-7-25-2)16(26)22-15(13)24/h4-5,8H,3,6-7H2,1-2H3,(H,22,24,26)
InChIKey DSZYYSWIZONTAV-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21861
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: 2163712; UZI_ID: UZI-021869
Temperature 308 °C