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5-((4-(2,6-Dioxo-1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-8-yl)oxy)-3-methoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazole

View entire compound with spectra: 1 MS (GC)

5-((4-(2,6-Dioxo-1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-8-yl)oxy)-3-methoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazole
SpectraBase Compound ID IeirN84slpd
InChI InChI=1S/C25H26N6O4/c1-14-6-8-15(9-7-14)17-13-18(28-27-17)16-10-11-19(20(12-16)34-5)35-24-26-22-21(29(24)2)23(32)31(4)25(33)30(22)3/h6-12,18,28H,13H2,1-5H3
InChIKey ZTXASOKAXWKONM-UHFFFAOYSA-N
Mol Weight 474.52 g/mol
Molecular Formula C25H26N6O4
Exact Mass 474.201553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KFlZ6hqeTiy
Name 5-((4-(2,6-Dioxo-1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-8-yl)oxy)-3-methoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazole
Alternate Name(s) 8-(2-Methoxy-4-(3-(p-tolyl)-4,5-dihydro-1H-pyrazol-5-yl)phenoxy)-1,3,7-trimethyl-1H-purine-2,6(3H,7H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26N6O4
InChI InChI=1S/C25H26N6O4/c1-14-6-8-15(9-7-14)17-13-18(28-27-17)16-10-11-19(20(12-16)34-5)35-24-26-22-21(29(24)2)23(32)31(4)25(33)30(22)3/h6-12,18,28H,13H2,1-5H3
InChIKey ZTXASOKAXWKONM-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.ejmech.2015.02.040
Molecular Weight 474.521 g/mol
SMILES N1C(CC(=N1)c1ccc(cc1)C)c1cc(OC)c(cc1)Oc1nc2c([n]1C)C(=O)N(C)C(=O)N2C
SPLASH splash10-00di-0110900000-a5249c068d981e85d1ac
Source of Spectrum EMC-93-407-6d
Wiley ID 1761265