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(E)-1-[3-(Furan-2-yl)-5-methyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]-3-(3,4,5-trimethoxyphenyl)-prop-2-en-1-one
SpectraBase Compound ID FyxJSuTdQbf
InChI InChI=1S/C26H23N3O7/c1-16-24(20(30)12-7-17-14-22(33-2)26(35-4)23(15-17)34-3)25(21-6-5-13-36-21)27-28(16)18-8-10-19(11-9-18)29(31)32/h5-15H,1-4H3/b12-7+
InChIKey LUDHTYUPMOLEQY-KPKJPENVSA-N
Mol Weight 489.48 g/mol
Molecular Formula C26H23N3O7
Exact Mass 489.1536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ANMzArVEKnk
Name (E)-1-[3-(Furan-2-yl)-5-methyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]-3-(3,4,5-trimethoxyphenyl)-prop-2-en-1-one
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H23N3O7
InChI InChI=1S/C26H23N3O7/c1-16-24(20(30)12-7-17-14-22(33-2)26(35-4)23(15-17)34-3)25(21-6-5-13-36-21)27-28(16)18-8-10-19(11-9-18)29(31)32/h5-15H,1-4H3/b12-7+
InChIKey LUDHTYUPMOLEQY-KPKJPENVSA-N
Instrument Name Shimadzu GCMS-QP-1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/ardp.202100381
Molecular Weight 489.484 g/mol
SMILES c1(occc1)-c1n[n](c(c1C(\C=C\c1cc(c(c(c1)OC)OC)OC)=O)C)-c1ccc(cc1)[N+](=O)[O-]
SPLASH splash10-0019-0300900000-8c687a2716936470d386
Source of Spectrum APC-355-8-7f
Wiley ID 1868731