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4-bromo-2-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenyl 4-methoxybenzoate
SpectraBase Compound ID Ea0Ygvdje1Q
InChI InChI=1S/C19H13BrN2O5S/c1-26-13-5-2-10(3-6-13)18(25)27-15-7-4-12(20)8-11(15)9-14-16(23)21-19(28)22-17(14)24/h2-9H,1H3,(H2,21,22,23,24,28)
InChIKey LASVYPAGSOTYSD-UHFFFAOYSA-N
Mol Weight 461.29 g/mol
Molecular Formula C19H13BrN2O5S
Exact Mass 459.972856 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6pa49fAgXTb
Name 4-bromo-2-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenyl 4-methoxybenzoate
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/C19H13BrN2O5S/c1-26-13-5-2-10(3-6-13)18(25)27-15-7-4-12(20)8-11(15)9-14-16(23)21-19(28)22-17(14)24/h2-9H,1H3,(H2,21,22,23,24,28)
InChIKey LASVYPAGSOTYSD-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6183
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/1008625; UBI_ID: UBI-006185
Temperature 308 °C