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5-{3-bromo-4-[(3-nitrobenzyl)oxy]benzylidene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID JZBpM4nDHRf
InChI InChI=1S/C18H12BrN3O5S/c19-14-8-10(7-13-16(23)20-18(28)21-17(13)24)4-5-15(14)27-9-11-2-1-3-12(6-11)22(25)26/h1-8H,9H2,(H2,20,21,23,24,28)
InChIKey GNPZZTNPQDKJIM-UHFFFAOYSA-N
Mol Weight 462.27 g/mol
Molecular Formula C18H12BrN3O5S
Exact Mass 460.968105 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8Eu33sF864p
Name 5-{3-bromo-4-[(3-nitrobenzyl)oxy]benzylidene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
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/C18H12BrN3O5S/c19-14-8-10(7-13-16(23)20-18(28)21-17(13)24)4-5-15(14)27-9-11-2-1-3-12(6-11)22(25)26/h1-8H,9H2,(H2,20,21,23,24,28)
InChIKey GNPZZTNPQDKJIM-UHFFFAOYSA-N
NMR Offset 17.5285
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14222
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: UZI/1011254; UBI_ID: UBI-014225
Temperature 300 °C