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

*Links on SpectraBase are not permalinks.
8-[(4-methoxybenzyl)amino]-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID JIPsNHoLPzO
InChI InChI=1S/C22H23N5O3/c1-14-5-4-6-16(11-14)13-27-18-19(26(2)22(29)25-20(18)28)24-21(27)23-12-15-7-9-17(30-3)10-8-15/h4-11H,12-13H2,1-3H3,(H,23,24)(H,25,28,29)
InChIKey XEMAZDORZZFBGP-UHFFFAOYSA-N
Mol Weight 405.46 g/mol
Molecular Formula C22H23N5O3
Exact Mass 405.18009 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 DpJWwEwnMxG
Name 8-[(4-methoxybenzyl)amino]-3-methyl-7-(3-methylbenzyl)-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/C22H23N5O3/c1-14-5-4-6-16(11-14)13-27-18-19(26(2)22(29)25-20(18)28)24-21(27)23-12-15-7-9-17(30-3)10-8-15/h4-11H,12-13H2,1-3H3,(H,23,24)(H,25,28,29)
InChIKey XEMAZDORZZFBGP-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8894
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: D38770; Labnumber: UZ01F011-2422; SBI_ID: SBI-008897
Temperature 308 °C