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8-(2-bromophenoxy)-1-(4-chlorobenzyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione

View entire compound with spectra: 2 NMR

8-(2-bromophenoxy)-1-(4-chlorobenzyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID 1URZeDJea0R
InChI InChI=1S/C20H16BrClN4O3/c1-24-16-17(23-19(24)29-15-6-4-3-5-14(15)21)25(2)20(28)26(18(16)27)11-12-7-9-13(22)10-8-12/h3-10H,11H2,1-2H3
InChIKey FXJGYNHFHPMZBK-UHFFFAOYSA-N
Mol Weight 475.73 g/mol
Molecular Formula C20H16BrClN4O3
Exact Mass 474.009431 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 95rte8IQsPM
Name 8-(2-bromophenoxy)-1-(4-chlorobenzyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H16BrClN4O3/c1-24-16-17(23-19(24)29-15-6-4-3-5-14(15)21)25(2)20(28)26(18(16)27)11-12-7-9-13(22)10-8-12/h3-10H,11H2,1-2H3
InChIKey FXJGYNHFHPMZBK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9625
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: D55544; Labnumber: LRP02-0860; SBI_ID: SBI-009628
Temperature 318 °C