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5-{4-[(2-chlorobenzyl)oxy]benzylidene}-1,3-dimethyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID ECTS8ADLAJ
InChI InChI=1S/C20H17ClN2O3S/c1-22-18(24)16(19(25)23(2)20(22)27)11-13-7-9-15(10-8-13)26-12-14-5-3-4-6-17(14)21/h3-11H,12H2,1-2H3
InChIKey ZGTWRCHMZOAXIX-UHFFFAOYSA-N
Mol Weight 400.88 g/mol
Molecular Formula C20H17ClN2O3S
Exact Mass 400.064841 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KgfBMlonWJF
Name 5-{4-[(2-chlorobenzyl)oxy]benzylidene}-1,3-dimethyl-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/C20H17ClN2O3S/c1-22-18(24)16(19(25)23(2)20(22)27)11-13-7-9-15(10-8-13)26-12-14-5-3-4-6-17(14)21/h3-11H,12H2,1-2H3
InChIKey ZGTWRCHMZOAXIX-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8325
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: 9686827; UBI_ID: UBI-008328
Temperature 308 °C