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

View entire compound with spectra: 1 NMR

5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-6-[[[4-(1-methylethyl)phenyl]sulfonyl]methyl]-2-oxo-4-phenyl-, ethyl ester
SpectraBase Compound ID AbB5kr3G7z4
InChI InChI=1S/C23H26N2O5S/c1-4-30-22(26)20-19(24-23(27)25-21(20)17-8-6-5-7-9-17)14-31(28,29)18-12-10-16(11-13-18)15(2)3/h5-13,15,21H,4,14H2,1-3H3,(H2,24,25,27)
InChIKey JLGCCODJOZRISB-UHFFFAOYSA-N
Mol Weight 442.53 g/mol
Molecular Formula C23H26N2O5S
Exact Mass 442.156243 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G3cq6izQ1W5
Name 5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-6-[[[4-(1-methylethyl)phenyl]sulfonyl]methyl]-2-oxo-4-phenyl-, 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 442.156243114 u
Formula C23H26N2O5S
InChI InChI=1S/C23H26N2O5S/c1-4-30-22(26)20-19(24-23(27)25-21(20)17-8-6-5-7-9-17)14-31(28,29)18-12-10-16(11-13-18)15(2)3/h5-13,15,21H,4,14H2,1-3H3,(H2,24,25,27)
InChIKey JLGCCODJOZRISB-UHFFFAOYSA-N
Molecular Weight 442.530 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6358
Solvent DMSO-d6
Source Vendor ID: NMR/13289538