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(E)-1-[3-(Furan-2-yl)-5-methyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]-3-phenylprop-2-en-1-one
SpectraBase Compound ID Jt6JRVM7uJF
InChI InChI=1S/C23H17N3O4/c1-16-22(20(27)14-9-17-6-3-2-4-7-17)23(21-8-5-15-30-21)24-25(16)18-10-12-19(13-11-18)26(28)29/h2-15H,1H3/b14-9+
InChIKey RZOHJLBBMJOGNC-NTEUORMPSA-N
Mol Weight 399.41 g/mol
Molecular Formula C23H17N3O4
Exact Mass 399.121906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWVh14NG1oI
Name (E)-1-[3-(Furan-2-yl)-5-methyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]-3-phenylprop-2-en-1-one
Appearance Beige crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17N3O4
InChI InChI=1S/C23H17N3O4/c1-16-22(20(27)14-9-17-6-3-2-4-7-17)23(21-8-5-15-30-21)24-25(16)18-10-12-19(13-11-18)26(28)29/h2-15H,1H3/b14-9+
InChIKey RZOHJLBBMJOGNC-NTEUORMPSA-N
Instrument Name Shimadzu GCMS-QP-1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/ardp.202100381
Molecular Weight 399.406 g/mol
SMILES c1(occc1)-c1n[n](c(c1C(\C=C\c1ccccc1)=O)C)-c1ccc(cc1)[N+](=O)[O-]
SPLASH splash10-00dj-2209000000-446287ec4a9e820021ec
Source of Spectrum APC-355-7-7a
Wiley ID 1868729