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1H-purine-2,6-dione, 7-[(2-chloro-6-fluorophenyl)methyl]-3,7-dihydro-8-[(3-methoxypropyl)amino]-1,3-dimethyl-
SpectraBase Compound ID CaAKf5gnrwp
InChI InChI=1S/C18H21ClFN5O3/c1-23-15-14(16(26)24(2)18(23)27)25(17(22-15)21-8-5-9-28-3)10-11-12(19)6-4-7-13(11)20/h4,6-7H,5,8-10H2,1-3H3,(H,21,22)
InChIKey FCFNNFKSGZNZKP-UHFFFAOYSA-N
Mol Weight 409.85 g/mol
Molecular Formula C18H21ClFN5O3
Exact Mass 409.131695 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HbWEvNoFL1z
Name 1H-purine-2,6-dione, 7-[(2-chloro-6-fluorophenyl)methyl]-3,7-dihydro-8-[(3-methoxypropyl)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/C18H21ClFN5O3/c1-23-15-14(16(26)24(2)18(23)27)25(17(22-15)21-8-5-9-28-3)10-11-12(19)6-4-7-13(11)20/h4,6-7H,5,8-10H2,1-3H3,(H,21,22)
InChIKey FCFNNFKSGZNZKP-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_3028
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/10218833