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6-Methyl-4-(4-methyl-3-nitro-phenyl)-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid 2-ethylsulfanyl-ethyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

6-Methyl-4-(4-methyl-3-nitro-phenyl)-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid 2-ethylsulfanyl-ethyl ester
SpectraBase Compound ID 96bts3wLzOl
InChI InChI=1S/C17H21N3O5S/c1-4-26-8-7-25-16(21)14-11(3)18-17(22)19-15(14)12-6-5-10(2)13(9-12)20(23)24/h5-6,9,15H,4,7-8H2,1-3H3,(H2,18,19,22)
InChIKey UZRQWJWZDFZFHG-UHFFFAOYSA-N
Mol Weight 379.43 g/mol
Molecular Formula C17H21N3O5S
Exact Mass 379.120192 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5JEs6CLdF10
Name 5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-6-methyl-4-(4-methyl-3-nitrophenyl)-2-oxo-, 2-(ethylthio)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 379.120191957 u
Formula C17H21N3O5S
InChI InChI=1S/C17H21N3O5S/c1-4-26-8-7-25-16(21)14-11(3)18-17(22)19-15(14)12-6-5-10(2)13(9-12)20(23)24/h5-6,9,15H,4,7-8H2,1-3H3,(H2,18,19,22)
InChIKey UZRQWJWZDFZFHG-UHFFFAOYSA-N
Molecular Weight 379.431 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16406
Solvent DMSO-d6
Source Vendor ID: NMR/10322885; Lab Info: SAS; Lab Number: SAS-tst4479