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7-benzyl-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione

View entire compound with spectra: 1 NMR

7-benzyl-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID 1OikU6vTIQn
InChI InChI=1S/C21H20N4O3/c1-14-9-7-8-12-16(14)28-20-22-18-17(19(26)24(3)21(27)23(18)2)25(20)13-15-10-5-4-6-11-15/h4-12H,13H2,1-3H3
InChIKey FKBGASRJBGIBBR-UHFFFAOYSA-N
Mol Weight 376.42 g/mol
Molecular Formula C21H20N4O3
Exact Mass 376.153541 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E80DQOzpr8t
Name 7-benzyl-1,3-dimethyl-8-(2-methylphenoxy)-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/C21H20N4O3/c1-14-9-7-8-12-16(14)28-20-22-18-17(19(26)24(3)21(27)23(18)2)25(20)13-15-10-5-4-6-11-15/h4-12H,13H2,1-3H3
InChIKey FKBGASRJBGIBBR-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_13347
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: 102121; Labnumber: LRP-640; VK_ID: VK-013352
Temperature 315 °C