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8-(4-Chlorobenzyl)-3,7-dihydro-1,3,7-trimethyl-1H-purin-2,6-dione

Compound with spectra: 1 NMR, and 2 MS (GC)

8-(4-Chlorobenzyl)-3,7-dihydro-1,3,7-trimethyl-1H-purin-2,6-dione
SpectraBase Compound ID FECDAlzL8Ow
InChI InChI=1S/C15H15ClN4O2/c1-18-11(8-9-4-6-10(16)7-5-9)17-13-12(18)14(21)20(3)15(22)19(13)2/h4-7H,8H2,1-3H3
InChIKey WFCVYRZIZRNVOT-UHFFFAOYSA-N
Mol Weight 318.76 g/mol
Molecular Formula C15H15ClN4O2
Exact Mass 318.088353 g/mol

View Spectrum of 8-(4-Chlorobenzyl)-3,7-dihydro-1,3,7-trimethyl-1H-purin-2,6-dione

13C NMR Spectrum
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View Spectrum of 8-(4-Chlorobenzyl)-3,7-dihydro-1,3,7-trimethyl-1H-purin-2,6-dione

MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum K-124-344-5

View Spectrum of 8-(4-Chlorobenzyl)-3,7-dihydro-1,3,7-trimethyl-1H-purin-2,6-dione

MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum K-124-344-5
  • 8-(4-Chlorobenzyl)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Caffeine, 8-(p-aminobenzyl)-
Purin-2,6-dione, 1,3,7-trimethyl-8-[2-(3-aminophen)ethyl]-
8-(Ethoxycarbonylmethyl)caffeine
8-(Butoxycarbonylmethyl)caffeine
8-(t-Butoxycarbonylmethyl)caffeine
1,3,7-trimethyl-8-sec-butyl-purine-2,6-dione
8-cyclohexyl-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
1,2,3,6-Tetrahydropurin-2,6-dione, 1,3,7-trimethyl-8-[2-(3-chlorophenyl)ethenyl]-
Purin-2,6-dione, 1,3,7-trimethyl-8-[2-[3-aminophenyl]ethenyl]-
Xanthine, 1,3,7-trimethyl-8-[2-(3,5-difluorophenyl)ethenyl]-

This compound is available in the following databases:

Wiley Registry of Mass Spectral Data 2023
Author: Wiley

The foundation library for any analytical laboratory running mass spectrometry, the Wiley Registry provides the broadest coverage available in any mass spectral library Learn more.

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