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1-[4-(2-bromo-4,5-diethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl]ethanone
SpectraBase Compound ID G49DpyKtNE9
InChI InChI=1S/C17H21BrN2O3S/c1-5-22-13-7-11(12(18)8-14(13)23-6-2)16-15(10(4)21)9(3)19-17(24)20-16/h7-8,16H,5-6H2,1-4H3,(H2,19,20,24)
InChIKey CJRZRPXTEHKCPX-UHFFFAOYSA-N
Mol Weight 413.33 g/mol
Molecular Formula C17H21BrN2O3S
Exact Mass 412.045627 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ifibqve1zeP
Name 1-[4-(2-bromo-4,5-diethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl]ethanone
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/C17H21BrN2O3S/c1-5-22-13-7-11(12(18)8-14(13)23-6-2)16-15(10(4)21)9(3)19-17(24)20-16/h7-8,16H,5-6H2,1-4H3,(H2,19,20,24)
InChIKey CJRZRPXTEHKCPX-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34771
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: 9329476; SBI_ID: SBI-034775
Temperature 315 °C