For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
7-(4-Chlorobenzyl)-8-(2-chlorophenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID 7qot8LmmKTa
InChI InChI=1S/C20H16Cl2N4O3/c1-24-17-16(18(27)25(2)20(24)28)26(11-12-7-9-13(21)10-8-12)19(23-17)29-15-6-4-3-5-14(15)22/h3-10H,11H2,1-2H3
InChIKey ONKQPFCSYYDIFA-UHFFFAOYSA-N
Mol Weight 431.28 g/mol
Molecular Formula C20H16Cl2N4O3
Exact Mass 430.059946 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2u38XIV4d3D
Name 1H-purine-2,6-dione, 8-(2-chlorophenoxy)-7-[(4-chlorophenyl)methyl]-3,7-dihydro-1,3-dimethyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 430.059945788 u
Formula C20H16Cl2N4O3
InChI InChI=1S/C20H16Cl2N4O3/c1-24-17-16(18(27)25(2)20(24)28)26(11-12-7-9-13(21)10-8-12)19(23-17)29-15-6-4-3-5-14(15)22/h3-10H,11H2,1-2H3
InChIKey ONKQPFCSYYDIFA-UHFFFAOYSA-N
Molecular Weight 431.279 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10331
Solvent DMSO-d6
Source Vendor ID: NMR/10241178; Lab Info: SAD; Lab Number: SAD-0001804
Temperature 23.85 °C