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methyl {8-[(dibenzylamino)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
SpectraBase Compound ID J2wwA73gMII
InChI InChI=1S/C25H27N5O4/c1-27-23-22(24(32)28(2)25(27)33)30(17-21(31)34-3)20(26-23)16-29(14-18-10-6-4-7-11-18)15-19-12-8-5-9-13-19/h4-13H,14-17H2,1-3H3
InChIKey KFNXJQPCSGTFBI-UHFFFAOYSA-N
Mol Weight 461.52 g/mol
Molecular Formula C25H27N5O4
Exact Mass 461.206304 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID o7u8SeVHuZ
Name methyl {8-[(dibenzylamino)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
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/C25H27N5O4/c1-27-23-22(24(32)28(2)25(27)33)30(17-21(31)34-3)20(26-23)16-29(14-18-10-6-4-7-11-18)15-19-12-8-5-9-13-19/h4-13H,14-17H2,1-3H3
InChIKey KFNXJQPCSGTFBI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9017
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: D51584; Labnumber: UZ01F011-2473; SBI_ID: SBI-009020
Temperature 318 °C