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8-(diethylamino)-7-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID 9WLtflPI0hr
InChI InChI=1S/C20H25N5O4/c1-6-24(7-2)19-21-17-16(18(27)23(4)20(28)22(17)3)25(19)12-15(26)13-8-10-14(29-5)11-9-13/h8-11H,6-7,12H2,1-5H3
InChIKey YFLAOPONIWRFCL-UHFFFAOYSA-N
Mol Weight 399.45 g/mol
Molecular Formula C20H25N5O4
Exact Mass 399.190654 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8pV8c3isFax
Name 8-(diethylamino)-7-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Alternate Name(s) 8-(diethylamino)-7-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-1,3-dimethyl-purine-2,6-dione 8-(diethylamino)-7-[2-(4-methoxyphenyl)-2-oxo-ethyl]-1,3-dimethyl-purine-2,6-dione 8-(diethylamino)-7-[2-keto-2-(4-methoxyphenyl)ethyl]-1,3-dimethyl-xanthine
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Formula C20H25N5O4
InChI InChI=1S/C20H25N5O4/c1-6-24(7-2)19-21-17-16(18(27)23(4)20(28)22(17)3)25(19)12-15(26)13-8-10-14(29-5)11-9-13/h8-11H,6-7,12H2,1-5H3
InChIKey YFLAOPONIWRFCL-UHFFFAOYSA-N
Molecular Weight 399.451 g/mol
SMILES c12c([n](CC(c3ccc(cc3)OC)=O)c(n1)N(CC)CC)C(=O)N(C(N2C)=O)C
SPLASH splash10-0f7a-4972000000-2e79efe223143981c26c
Wiley ID 1459948