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5-{2-[(4-bromobenzyl)oxy]-3-methoxybenzylidene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID KA5dmSEKKYZ
InChI InChI=1S/C19H15BrN2O4S/c1-25-15-4-2-3-12(9-14-17(23)21-19(27)22-18(14)24)16(15)26-10-11-5-7-13(20)8-6-11/h2-9H,10H2,1H3,(H2,21,22,23,24,27)
InChIKey VMINDYUMGZTEHD-UHFFFAOYSA-N
Mol Weight 447.3 g/mol
Molecular Formula C19H15BrN2O4S
Exact Mass 445.993591 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JvYVpIk0Uzy
Name 5-{2-[(4-bromobenzyl)oxy]-3-methoxybenzylidene}-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/C19H15BrN2O4S/c1-25-15-4-2-3-12(9-14-17(23)21-19(27)22-18(14)24)16(15)26-10-11-5-7-13(20)8-6-11/h2-9H,10H2,1H3,(H2,21,22,23,24,27)
InChIKey VMINDYUMGZTEHD-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11121
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: 1002941; UBI_ID: UBI-011124
Temperature 308 °C