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8-chloro-7-(2,4-dichlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID 41xpmSEsUIp
InChI InChI=1S/C14H11Cl3N4O2/c1-19-11-10(12(22)20(2)14(19)23)21(13(17)18-11)6-7-3-4-8(15)5-9(7)16/h3-5H,6H2,1-2H3
InChIKey LXPLGDPTTCGRDV-UHFFFAOYSA-N
Mol Weight 373.63 g/mol
Molecular Formula C14H11Cl3N4O2
Exact Mass 371.994759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BaCbkrIN0tQ
Name 8-Chloro-7-(2,4-dichlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
CAS Registry Number 109563-03-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11Cl3N4O2
InChI InChI=1S/C14H11Cl3N4O2/c1-19-11-10(12(22)20(2)14(19)23)21(13(17)18-11)6-7-3-4-8(15)5-9(7)16/h3-5H,6H2,1-2H3
InChIKey LXPLGDPTTCGRDV-UHFFFAOYSA-N
Molecular Weight 373.627 g/mol
SMILES c12c([n](Cc3c(cc(cc3)Cl)Cl)c(n1)Cl)C(=O)N(C(N2C)=O)C
SPLASH splash10-0bt9-2901000000-7b6facc04649fdbb590f
Source of Spectrum AD-0-2532-0
Synonyms 8-Chloranyl-7-[(2,4-dichlorophenyl)methyl]-1,3-dimethyl-purine-2,6-dione 8-Chloro-7-(2,4-dichlorobenzyl)-1,3-dimethyl-xanthine 8-Chloro-7-[(2,4-dichlorophenyl)methyl]-1,3-dimethyl-purine-2,6-dione Purine-2,6(1H,3H)-dione, 8-chloro-7-(2,4-dichlorobenzyl)-1,3-dimethyl-
Wiley ID 1430055