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methyl 4-{[7-(2-fluorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]oxy}benzoate
SpectraBase Compound ID G8Mwz0exufb
InChI InChI=1S/C22H19FN4O5/c1-25-18-17(19(28)26(2)22(25)30)27(12-14-6-4-5-7-16(14)23)21(24-18)32-15-10-8-13(9-11-15)20(29)31-3/h4-11H,12H2,1-3H3
InChIKey FWMYPWILQZFWRH-UHFFFAOYSA-N
Mol Weight 438.42 g/mol
Molecular Formula C22H19FN4O5
Exact Mass 438.133948 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AICSWrt9uVs
Name methyl 4-{[7-(2-fluorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]oxy}benzoate
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/C22H19FN4O5/c1-25-18-17(19(28)26(2)22(25)30)27(12-14-6-4-5-7-16(14)23)21(24-18)32-15-10-8-13(9-11-15)20(29)31-3/h4-11H,12H2,1-3H3
InChIKey FWMYPWILQZFWRH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_6142
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: NMR/11242380; Labnumber: SAD-0003036; IOH_ID: IOH-006143