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1H-purine-2,6-dione, 7-[(2-chloro-6-fluorophenyl)methyl]-3,7-dihydro-8-[(2-methoxyethyl)amino]-1,3-dimethyl-
SpectraBase Compound ID BxHJpSgITAK
InChI InChI=1S/C17H19ClFN5O3/c1-22-14-13(15(25)23(2)17(22)26)24(16(21-14)20-7-8-27-3)9-10-11(18)5-4-6-12(10)19/h4-6H,7-9H2,1-3H3,(H,20,21)
InChIKey BXAURXZAFDRUIL-UHFFFAOYSA-N
Mol Weight 395.82 g/mol
Molecular Formula C17H19ClFN5O3
Exact Mass 395.116045 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EqM4vfXVo6w
Name 1H-purine-2,6-dione, 7-[(2-chloro-6-fluorophenyl)methyl]-3,7-dihydro-8-[(2-methoxyethyl)amino]-1,3-dimethyl-
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/C17H19ClFN5O3/c1-22-14-13(15(25)23(2)17(22)26)24(16(21-14)20-7-8-27-3)9-10-11(18)5-4-6-12(10)19/h4-6H,7-9H2,1-3H3,(H,20,21)
InChIKey BXAURXZAFDRUIL-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_3027
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/10218832