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5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(2-methoxyphenyl)-6-methyl-2-oxo-, 2-(phenylthio)ethyl ester

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5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(2-methoxyphenyl)-6-methyl-2-oxo-, 2-(phenylthio)ethyl ester
SpectraBase Compound ID LrkXWZv8Amx
InChI InChI=1S/C21H22N2O4S/c1-14-18(20(24)27-12-13-28-15-8-4-3-5-9-15)19(23-21(25)22-14)16-10-6-7-11-17(16)26-2/h3-11,19H,12-13H2,1-2H3,(H2,22,23,25)
InChIKey WSZOJOQDUPJJIN-UHFFFAOYSA-N
Mol Weight 398.48 g/mol
Molecular Formula C21H22N2O4S
Exact Mass 398.130028 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9J8muWpNILi
Name 5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(2-methoxyphenyl)-6-methyl-2-oxo-, 2-(phenylthio)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/C21H22N2O4S/c1-14-18(20(24)27-12-13-28-15-8-4-3-5-9-15)19(23-21(25)22-14)16-10-6-7-11-17(16)26-2/h3-11,19H,12-13H2,1-2H3,(H2,22,23,25)
InChIKey WSZOJOQDUPJJIN-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_2724
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: ZI/6014001; Labnumber: SMM-820; IOH_ID: IOH-009727