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ethyl 4-[5-bromo-2-(2-ethoxy-2-oxoethoxy)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID AXQYvjH7VLU
InChI InChI=1S/C18H21BrN2O5S/c1-4-24-14(22)9-26-13-7-6-11(19)8-12(13)16-15(17(23)25-5-2)10(3)20-18(27)21-16/h6-8,16H,4-5,9H2,1-3H3,(H2,20,21,27)
InChIKey OTDDXJUZCSCSGN-UHFFFAOYSA-N
Mol Weight 457.34 g/mol
Molecular Formula C18H21BrN2O5S
Exact Mass 456.035456 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6xtPluhmX8v
Name ethyl 4-[5-bromo-2-(2-ethoxy-2-oxoethoxy)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
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/C18H21BrN2O5S/c1-4-24-14(22)9-26-13-7-6-11(19)8-12(13)16-15(17(23)25-5-2)10(3)20-18(27)21-16/h6-8,16H,4-5,9H2,1-3H3,(H2,20,21,27)
InChIKey OTDDXJUZCSCSGN-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34776
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: 9338432; SBI_ID: SBI-034780
Temperature 315 °C