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

*Links on SpectraBase are not permalinks.

5-pyrimidinecarboxylic acid, 6-[[(4-chlorophenyl)thio]methyl]-4-(2,5-dimethylphenyl)-1,2,3,4-tetrahydro-2-oxo-, ethyl ester

View entire compound with spectra: 1 NMR

5-pyrimidinecarboxylic acid, 6-[[(4-chlorophenyl)thio]methyl]-4-(2,5-dimethylphenyl)-1,2,3,4-tetrahydro-2-oxo-, ethyl ester
SpectraBase Compound ID K4SCaEmG83j
InChI InChI=1S/C22H23ClN2O3S/c1-4-28-21(26)19-18(12-29-16-9-7-15(23)8-10-16)24-22(27)25-20(19)17-11-13(2)5-6-14(17)3/h5-11,20H,4,12H2,1-3H3,(H2,24,25,27)
InChIKey KWXVECJCHYYHBA-UHFFFAOYSA-N
Mol Weight 430.95 g/mol
Molecular Formula C22H23ClN2O3S
Exact Mass 430.111791 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 Iq8iCLQ9lJH
Name 5-pyrimidinecarboxylic acid, 6-[[(4-chlorophenyl)thio]methyl]-4-(2,5-dimethylphenyl)-1,2,3,4-tetrahydro-2-oxo-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 430.111791480 u
Formula C22H23ClN2O3S
InChI InChI=1S/C22H23ClN2O3S/c1-4-28-21(26)19-18(12-29-16-9-7-15(23)8-10-16)24-22(27)25-20(19)17-11-13(2)5-6-14(17)3/h5-11,20H,4,12H2,1-3H3,(H2,24,25,27)
InChIKey KWXVECJCHYYHBA-UHFFFAOYSA-N
Molecular Weight 430.950 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_9320
Solvent DMSO-d6
Source Vendor ID: NMR/14228167