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7-(2-chloro-6-fluorobenzyl)-8-(2,6-dimethyl-4-morpholinyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID HUYcKthypkz
InChI InChI=1S/C20H23ClFN5O3/c1-11-8-26(9-12(2)30-11)19-23-17-16(18(28)25(4)20(29)24(17)3)27(19)10-13-14(21)6-5-7-15(13)22/h5-7,11-12H,8-10H2,1-4H3
InChIKey AJQZTAKQBATWLI-UHFFFAOYSA-N
Mol Weight 435.89 g/mol
Molecular Formula C20H23ClFN5O3
Exact Mass 435.147345 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1by5geGCiUR
Name 7-(2-chloro-6-fluorobenzyl)-8-(2,6-dimethyl-4-morpholinyl)-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/C20H23ClFN5O3/c1-11-8-26(9-12(2)30-11)19-23-17-16(18(28)25(4)20(29)24(17)3)27(19)10-13-14(21)6-5-7-15(13)22/h5-7,11-12H,8-10H2,1-4H3
InChIKey AJQZTAKQBATWLI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25724
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: D60615; Labnumber: LRP02-0833; SBI_ID: SBI-025728
Temperature 318 °C