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

*Links on SpectraBase are not permalinks.
benzoic acid, 4-[[[[1,6-dihydro-4-[[(4-methylphenyl)thio]methyl]-6-oxo-2-pyrimidinyl]thio]acetyl]amino]-, ethyl ester
SpectraBase Compound ID G9olACxTVLT
InChI InChI=1S/C23H23N3O4S2/c1-3-30-22(29)16-6-8-17(9-7-16)24-21(28)14-32-23-25-18(12-20(27)26-23)13-31-19-10-4-15(2)5-11-19/h4-12H,3,13-14H2,1-2H3,(H,24,28)(H,25,26,27)
InChIKey CJLZYUFIDJLHTQ-UHFFFAOYSA-N
Mol Weight 469.57 g/mol
Molecular Formula C23H23N3O4S2
Exact Mass 469.112999 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 LPmsw9WnGk4
Name benzoic acid, 4-[[[[1,6-dihydro-4-[[(4-methylphenyl)thio]methyl]-6-oxo-2-pyrimidinyl]thio]acetyl]amino]-, ethyl ester
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/C23H23N3O4S2/c1-3-30-22(29)16-6-8-17(9-7-16)24-21(28)14-32-23-25-18(12-20(27)26-23)13-31-19-10-4-15(2)5-11-19/h4-12H,3,13-14H2,1-2H3,(H,24,28)(H,25,26,27)
InChIKey CJLZYUFIDJLHTQ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_182
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: NMR/11249904