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8-[(4-methoxybenzyl)amino]-1,3-dimethyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID 3nREDqGssHD
InChI InChI=1S/C23H25N5O3/c1-15-6-5-7-17(12-15)14-28-19-20(26(2)23(30)27(3)21(19)29)25-22(28)24-13-16-8-10-18(31-4)11-9-16/h5-12H,13-14H2,1-4H3,(H,24,25)
InChIKey TXTBXCMXOXXFTE-UHFFFAOYSA-N
Mol Weight 419.49 g/mol
Molecular Formula C23H25N5O3
Exact Mass 419.19574 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9laYwB8anWY
Name 8-[(4-methoxybenzyl)amino]-1,3-dimethyl-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/C23H25N5O3/c1-15-6-5-7-17(12-15)14-28-19-20(26(2)23(30)27(3)21(19)29)25-22(28)24-13-16-8-10-18(31-4)11-9-16/h5-12H,13-14H2,1-4H3,(H,24,25)
InChIKey TXTBXCMXOXXFTE-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8902
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: D38778; Labnumber: UZ01F011-2430; SBI_ID: SBI-008905
Temperature 308 °C