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

*Links on SpectraBase are not permalinks.
8-[(2,4-dichlorobenzyl)oxy]-7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID LO8nDv1fk4h
InChI InChI=1S/C21H17Cl2FN4O3/c1-26-18-17(19(29)27(2)21(26)30)28(10-12-3-7-15(24)8-4-12)20(25-18)31-11-13-5-6-14(22)9-16(13)23/h3-9H,10-11H2,1-2H3
InChIKey LZQGEZNOSOANRO-UHFFFAOYSA-N
Mol Weight 463.3 g/mol
Molecular Formula C21H17Cl2FN4O3
Exact Mass 462.066174 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 C3BGeGWxP9e
Name 8-[(2,4-dichlorobenzyl)oxy]-7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
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/C21H17Cl2FN4O3/c1-26-18-17(19(29)27(2)21(26)30)28(10-12-3-7-15(24)8-4-12)20(25-18)31-11-13-5-6-14(22)9-16(13)23/h3-9H,10-11H2,1-2H3
InChIKey LZQGEZNOSOANRO-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4599
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: E09578; Labnumber: LRP02-1366; SBI_ID: SBI-004601
Temperature 308 °C