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(E,E)-1,1'-(5-Methyl-1-(4-tolyl)-1H-pyrazole-3,4-diyl)bis(3-(4-methoxyphenyl)prop-2-en-1-one)
SpectraBase Compound ID 7ZeU9Yt1Nyt
InChI InChI=1S/C31H28N2O4/c1-21-5-13-25(14-6-21)33-22(2)30(28(34)19-11-23-7-15-26(36-3)16-8-23)31(32-33)29(35)20-12-24-9-17-27(37-4)18-10-24/h5-20H,1-4H3/b19-11+,20-12+
InChIKey DPWBAFNWVXOFPM-AYKLPDECSA-N
Mol Weight 492.58 g/mol
Molecular Formula C31H28N2O4
Exact Mass 492.204907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1byuUIp5ZgR
Name (E,E)-1,1'-(5-Methyl-1-(4-tolyl)-1H-pyrazole-3,4-diyl)bis(3-(4-methoxyphenyl)prop-2-en-1-one)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H28N2O4
InChI InChI=1S/C31H28N2O4/c1-21-5-13-25(14-6-21)33-22(2)30(28(34)19-11-23-7-15-26(36-3)16-8-23)31(32-33)29(35)20-12-24-9-17-27(37-4)18-10-24/h5-20H,1-4H3/b19-11+,20-12+
InChIKey DPWBAFNWVXOFPM-AYKLPDECSA-N
Literature Reference DOI 10.1002/jccs.201190137
Molecular Weight 492.575 g/mol
SMILES c1(n[n](c(c1C(\C=C\c1ccc(cc1)OC)=O)C)-c1ccc(cc1)C)C(\C=C\c1ccc(cc1)OC)=O
SPLASH splash10-0a4i-2090000000-fdedee16f21f67df1e14
Source of Spectrum QA-58-867-3f
Synonyms (2E,2'E)-1,1'-(5-methyl-1-(p-tolyl)-1H-pyrazole-3,4-diyl)bis(3-(4-methoxyphenyl)prop-2-en-1-one)
Wiley ID 1796582