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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)-1-formyl-3-(4-methoxyphenyl)-4,5-dihydro-1H-pirazole

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)-1-formyl-3-(4-methoxyphenyl)-4,5-dihydro-1H-pirazole
SpectraBase Compound ID F7wsY6c3L51
InChI InChI=1S/C26H26N6O6/c1-29-22-23(30(2)26(35)31(3)24(22)34)27-25(29)38-20-11-8-16(12-21(20)37-5)19-13-18(28-32(19)14-33)15-6-9-17(36-4)10-7-15/h6-12,14,19H,13H2,1-5H3
InChIKey UBCGYBSYGKIZPM-UHFFFAOYSA-N
Mol Weight 518.53 g/mol
Molecular Formula C26H26N6O6
Exact Mass 518.191383 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZGF9RxUfX3
Name 5-((4-(2,6-Dioxo-1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-8-yl)oxy)-3-methoxyphenyl)-1-formyl-3-(4-methoxyphenyl)-4,5-dihydro-1H-pirazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26N6O6
InChI InChI=1S/C26H26N6O6/c1-29-22-23(30(2)26(35)31(3)24(22)34)27-25(29)38-20-11-8-16(12-21(20)37-5)19-13-18(28-32(19)14-33)15-6-9-17(36-4)10-7-15/h6-12,14,19H,13H2,1-5H3
InChIKey UBCGYBSYGKIZPM-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.ejmech.2015.02.040
Molecular Weight 518.530 g/mol
SMILES CN1C(=O)N(C)c2c([n](c(Oc3ccc(C4CC(=NN4C=O)c4ccc(cc4)OC)cc3OC)n2)C)C1=O
SPLASH splash10-014i-0000090000-fa6df233157927baf475
Source of Spectrum EMC-93-409-8e
Synonyms 5-(3-Methoxy-4-((1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)oxy)phenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde
Wiley ID 1761271