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1H-purine-2,6-dione, 7-[(2-chlorophenyl)methyl]-8-[[2-(diethylamino)ethyl]amino]-3,7-dihydro-1,3-dimethyl-
SpectraBase Compound ID AvlK7wKLMXA
InChI InChI=1S/C20H27ClN6O2/c1-5-26(6-2)12-11-22-19-23-17-16(18(28)25(4)20(29)24(17)3)27(19)13-14-9-7-8-10-15(14)21/h7-10H,5-6,11-13H2,1-4H3,(H,22,23)
InChIKey ATDITNCMZRPWLH-UHFFFAOYSA-N
Mol Weight 418.93 g/mol
Molecular Formula C20H27ClN6O2
Exact Mass 418.188402 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JPnwr96XbwX
Name 1H-purine-2,6-dione, 7-[(2-chlorophenyl)methyl]-8-[[2-(diethylamino)ethyl]amino]-3,7-dihydro-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/C20H27ClN6O2/c1-5-26(6-2)12-11-22-19-23-17-16(18(28)25(4)20(29)24(17)3)27(19)13-14-9-7-8-10-15(14)21/h7-10H,5-6,11-13H2,1-4H3,(H,22,23)
InChIKey ATDITNCMZRPWLH-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_2994
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/10218775