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(5-Benzoyl-5-hydroxy-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)(4- bromophenyl)methanone
SpectraBase Compound ID 6zi9ERmncD6
InChI InChI=1S/C23H17BrN2O3/c24-19-13-11-18(12-14-19)22(28)26-23(29,21(27)17-9-5-2-6-10-17)15-20(25-26)16-7-3-1-4-8-16/h1-14,29H,15H2
InChIKey WMMXPOYKCJNOHQ-UHFFFAOYSA-N
Mol Weight 449.3 g/mol
Molecular Formula C23H17BrN2O3
Exact Mass 448.042255 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FFtncvbNslP
Name (5-Benzoyl-5-hydroxy-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)(4- bromophenyl)methanone
Appearance Beige solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17BrN2O3
InChI InChI=1S/C23H17BrN2O3/c24-19-13-11-18(12-14-19)22(28)26-23(29,21(27)17-9-5-2-6-10-17)15-20(25-26)16-7-3-1-4-8-16/h1-14,29H,15H2
InChIKey WMMXPOYKCJNOHQ-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.15.136
Molecular Weight 449.304 g/mol
SMILES OC1(C(c2ccccc2)=O)N(N=C(C1)c1ccccc1)C(=O)c1ccc(cc1)Br
SPLASH splash10-0002-1953000000-5bd6a59919ab9fd5b774
Source of Spectrum BJO-15-SM11-5d
Thin-Layer Chromatography Rf = 0.19 (petroleum ether/ethyl acetate, 5:1)
Wiley ID 1840926