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1,3-dimethyl-8-(4-methyl-1-piperidinyl)-7-(4-nitrobenzyl)-3,7-dihydro-1H-purine-2,6-dione

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1,3-dimethyl-8-(4-methyl-1-piperidinyl)-7-(4-nitrobenzyl)-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID 2ax6kOg0Zeg
InChI InChI=1S/C20H24N6O4/c1-13-8-10-24(11-9-13)19-21-17-16(18(27)23(3)20(28)22(17)2)25(19)12-14-4-6-15(7-5-14)26(29)30/h4-7,13H,8-12H2,1-3H3
InChIKey COJROSKWYDTYSU-UHFFFAOYSA-N
Mol Weight 412.45 g/mol
Molecular Formula C20H24N6O4
Exact Mass 412.185903 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BnYMVfxviQ7
Name 1,3-dimethyl-8-(4-methyl-1-piperidinyl)-7-(4-nitrobenzyl)-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/C20H24N6O4/c1-13-8-10-24(11-9-13)19-21-17-16(18(27)23(3)20(28)22(17)2)25(19)12-14-4-6-15(7-5-14)26(29)30/h4-7,13H,8-12H2,1-3H3
InChIKey COJROSKWYDTYSU-UHFFFAOYSA-N
NMR Offset 16.5783
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_SBI_36227_8709
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: D36286; Labnumber: LRP02-0438; SBI_ID: SBI-008712
Temperature 315 °C