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5-pyrimidinecarboxylic acid, 6-[[(3,4-dimethylphenyl)sulfonyl]methyl]-1,2,3,4-tetrahydro-4-(4-hydroxyphenyl)-2-oxo-,
SpectraBase Compound ID BtfaP2voOiS
InChI InChI=1S/C22H24N2O6S/c1-4-30-21(26)19-18(12-31(28,29)17-10-5-13(2)14(3)11-17)23-22(27)24-20(19)15-6-8-16(25)9-7-15/h5-11,20,25H,4,12H2,1-3H3,(H2,23,24,27)
InChIKey UGWXCSWOPVXWNJ-UHFFFAOYSA-N
Mol Weight 444.5 g/mol
Molecular Formula C22H24N2O6S
Exact Mass 444.135508 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DVHlGxy9dT6
Name 5-pyrimidinecarboxylic acid, 6-[[(3,4-dimethylphenyl)sulfonyl]methyl]-1,2,3,4-tetrahydro-4-(4-hydroxyphenyl)-2-oxo-,
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 444.135507669 u
Formula C22H24N2O6S
InChI InChI=1S/C22H24N2O6S/c1-4-30-21(26)19-18(12-31(28,29)17-10-5-13(2)14(3)11-17)23-22(27)24-20(19)15-6-8-16(25)9-7-15/h5-11,20,25H,4,12H2,1-3H3,(H2,23,24,27)
InChIKey UGWXCSWOPVXWNJ-UHFFFAOYSA-N
Molecular Weight 444.502 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4142
Solvent DMSO-d6
Source Vendor ID: NMR/13279639