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

View entire compound with spectra: 1 NMR

5-pyrimidinecarboxylic acid, 6-[[(4-chlorophenyl)sulfonyl]methyl]-1,2,3,4-tetrahydro-4-(4-hydroxy-3-methoxyphenyl)-2-oxo-, ethyl ester
SpectraBase Compound ID HVh0VFRm02c
InChI InChI=1S/C21H21ClN2O7S/c1-3-31-20(26)18-15(11-32(28,29)14-7-5-13(22)6-8-14)23-21(27)24-19(18)12-4-9-16(25)17(10-12)30-2/h4-10,19,25H,3,11H2,1-2H3,(H2,23,24,27)
InChIKey MHKCZDRNRVVCHT-UHFFFAOYSA-N
Mol Weight 480.92 g/mol
Molecular Formula C21H21ClN2O7S
Exact Mass 480.0758 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2fqg17oOw1R
Name 5-pyrimidinecarboxylic acid, 6-[[(4-chlorophenyl)sulfonyl]methyl]-1,2,3,4-tetrahydro-4-(4-hydroxy-3-methoxyphenyl)-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 480.075799891 u
Formula C21H21ClN2O7S
InChI InChI=1S/C21H21ClN2O7S/c1-3-31-20(26)18-15(11-32(28,29)14-7-5-13(22)6-8-14)23-21(27)24-19(18)12-4-9-16(25)17(10-12)30-2/h4-10,19,25H,3,11H2,1-2H3,(H2,23,24,27)
InChIKey MHKCZDRNRVVCHT-UHFFFAOYSA-N
Molecular Weight 480.919 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6356
Solvent DMSO-d6
Source Vendor ID: NMR/13289536