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(E)-3-((4-(2,6-Dioxo-1,3,7-trimethyl-2,3,6,7-tetrahydro-1hpurine-8-yl)oxy)-3-methoxyphenyl)-1-(4-methylphenyl)-prop-2-en-1-one

View entire compound with spectra: 1 MS (GC)

(E)-3-((4-(2,6-Dioxo-1,3,7-trimethyl-2,3,6,7-tetrahydro-1hpurine-8-yl)oxy)-3-methoxyphenyl)-1-(4-methylphenyl)-prop-2-en-1-one
SpectraBase Compound ID GiCbfvEQff6
InChI InChI=1S/C25H24N4O5/c1-15-6-10-17(11-7-15)18(30)12-8-16-9-13-19(20(14-16)33-5)34-24-26-22-21(27(24)2)23(31)29(4)25(32)28(22)3/h6-14H,1-5H3/b12-8+
InChIKey RUQFLVCHTXWMSS-XYOKQWHBSA-N
Mol Weight 460.49 g/mol
Molecular Formula C25H24N4O5
Exact Mass 460.17467 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KSuqMUmT2SW
Name (E)-3-((4-(2,6-Dioxo-1,3,7-trimethyl-2,3,6,7-tetrahydro-1hpurine-8-yl)oxy)-3-methoxyphenyl)-1-(4-methylphenyl)-prop-2-en-1-one
Alternate Name(s) (E)-8-(2-methoxy-4-(3-oxo-3-(p-tolyl)prop-1-en-1-yl)phenoxy)-1,3,7-trimethyl-1H-purine-2,6(3H,7H)-dione
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Formula C25H24N4O5
InChI InChI=1S/C25H24N4O5/c1-15-6-10-17(11-7-15)18(30)12-8-16-9-13-19(20(14-16)33-5)34-24-26-22-21(27(24)2)23(31)29(4)25(32)28(22)3/h6-14H,1-5H3/b12-8+
InChIKey RUQFLVCHTXWMSS-XYOKQWHBSA-N
Literature Reference DOI 10.1016/j.ejmech.2015.02.040
Molecular Weight 460.490 g/mol
SMILES CN1C(=O)N(C)c2nc([n](c2C1=O)C)Oc1ccc(cc1OC)\C=C\C(c1ccc(cc1)C)=O
SPLASH splash10-03di-0000900000-593c3846c60e60324f52
Source of Spectrum EMC-93-406-5d
Wiley ID 1761259