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3-Methyl-8-(4-morpholinyl)-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID CTi8pFdAJo
InChI InChI=1S/C18H21N5O4/c1-21-15-14(16(24)20-18(21)25)23(9-12-27-13-5-3-2-4-6-13)17(19-15)22-7-10-26-11-8-22/h2-6H,7-12H2,1H3,(H,20,24,25)
InChIKey ODVAGHYWBQCJFU-UHFFFAOYSA-N
Mol Weight 371.4 g/mol
Molecular Formula C18H21N5O4
Exact Mass 371.159354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B6tgTRw2EdC
Name 3-Methyl-8-(4-morpholinyl)-7-(2-phenoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Alternate Name(s) 3-Methyl-8-(4-morpholinyl)-7-(2-phenoxyethyl)purine-2,6-dione 3-Methyl-8-morpholin-4-yl-7-(2-phenoxy-ethyl)-3,7(1H)-dihydro-purine-2,6-dione 3-Methyl-8-morpholin-4-yl-7-(2-phenoxyethyl)purine-2,6-dione 3-Methyl-8-morpholino-7-(2-phenoxyethyl)purine-2,6-dione 3-Methyl-8-morpholino-7-(2-phenoxyethyl)xanthine
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Formula C18H21N5O4
InChI InChI=1S/C18H21N5O4/c1-21-15-14(16(24)20-18(21)25)23(9-12-27-13-5-3-2-4-6-13)17(19-15)22-7-10-26-11-8-22/h2-6H,7-12H2,1H3,(H,20,24,25)
InChIKey ODVAGHYWBQCJFU-UHFFFAOYSA-N
Molecular Weight 371.397 g/mol
SMILES N1C(N(c2c(C1=O)[n](c(n2)N1CCOCC1)CCOc1ccccc1)C)=O
SPLASH splash10-0ukc-9552000000-8aee818acd855abaf660
Wiley ID 1438602