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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3eoc0FExKy
Name 8-(4-Chlorobenzyl)-3,7-dihydro-1,3,7-trimethyl-1H-purin-2,6-dione
Alternate Name(s) 8-(4-Chlorobenzyl)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
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Formula C15H15ClN4O2
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
Molecular Weight 318.764 g/mol
SMILES C1(N(C(N(c2c1[n](c(n2)Cc1ccc(cc1)Cl)C)C)=O)C)=O
SPLASH splash10-01kc-0509000000-13de53eea3687209e43b
Source of Spectrum K-124-344-5
Wiley ID 1792155