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3-(5-Hydroxy-1-phenyl-3-pyridin-4-yl-1H-pyrazol-4-yl)-3-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-1-one
SpectraBase Compound ID HpePyt1rjik
InChI InChI=1S/C31H27N3O3/c1-21-8-10-23(11-9-21)28(35)20-27(22-12-14-26(37-2)15-13-22)29-30(24-16-18-32-19-17-24)33-34(31(29)36)25-6-4-3-5-7-25/h3-19,27,36H,20H2,1-2H3
InChIKey JBLUQLYZRLNBFX-UHFFFAOYSA-N
Mol Weight 489.58 g/mol
Molecular Formula C31H27N3O3
Exact Mass 489.205242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LXxT8LrUcl9
Name 3-(5-Hydroxy-1-phenyl-3-pyridin-4-yl-1H-pyrazol-4-yl)-3-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H27N3O3
InChI InChI=1S/C31H27N3O3/c1-21-8-10-23(11-9-21)28(35)20-27(22-12-14-26(37-2)15-13-22)29-30(24-16-18-32-19-17-24)33-34(31(29)36)25-6-4-3-5-7-25/h3-19,27,36H,20H2,1-2H3
InChIKey JBLUQLYZRLNBFX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200400146
Molecular Weight 489.575 g/mol
SMILES c1ccccc1-[n]1c(c(c(n1)-c1ccncc1)C(c1ccc(OC)cc1)CC(=O)c1ccc(C)cc1)O
SPLASH splash10-0r00-1960000000-8a7669b61c901783253c
Source of Spectrum QA-51-989-14b
Synonyms 3-(5-hydroxy-1-phenyl-3-(pyridin-4-yl)-1H-pyrazol-4-yl)-3-(4-methoxyphenyl)-1-(p-tolyl)propan-1-one
Wiley ID 1795979