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8-(benzylamino)-7-{[3-(2-methoxyphenyl)-4,5-dihydro-5-isoxazolyl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID IN21eaBhEEn
InChI InChI=1S/C25H26N6O4/c1-29-22-21(23(32)30(2)25(29)33)31(24(27-22)26-14-16-9-5-4-6-10-16)15-17-13-19(28-35-17)18-11-7-8-12-20(18)34-3/h4-12,17H,13-15H2,1-3H3,(H,26,27)
InChIKey RYBDMVURCSYDQF-UHFFFAOYSA-N
Mol Weight 474.52 g/mol
Molecular Formula C25H26N6O4
Exact Mass 474.201553 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DxrLKR6DR2d
Name 8-(benzylamino)-7-{[3-(2-methoxyphenyl)-4,5-dihydro-5-isoxazolyl]methyl}-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/C25H26N6O4/c1-29-22-21(23(32)30(2)25(29)33)31(24(27-22)26-14-16-9-5-4-6-10-16)15-17-13-19(28-35-17)18-11-7-8-12-20(18)34-3/h4-12,17H,13-15H2,1-3H3,(H,26,27)
InChIKey RYBDMVURCSYDQF-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_2165
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: 801663LRP-1023; Labnumber: 801663LRP-1023; VK_ID: VK-002166
Temperature 318 °C