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Acetophenone, 4'-bromo-2-[3-(p-bromophenyl)-5-phenyl-2-isoxazolin-5-yl]-
SpectraBase Compound ID K7SVfx7eXIg
InChI InChI=1S/C23H17Br2NO2/c24-19-10-6-16(7-11-19)21-14-23(28-26-21,18-4-2-1-3-5-18)15-22(27)17-8-12-20(25)13-9-17/h1-13H,14-15H2
InChIKey KKCIXLIFXAAGLS-UHFFFAOYSA-N
Mol Weight 499.2 g/mol
Molecular Formula C23H17Br2NO2
Exact Mass 496.962605 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3MJMiyzRkO
Name Acetophenone, 4'-bromo-2-[3-(p-bromophenyl)-5-phenyl-2-isoxazolin-5-yl]-
Alternate Name(s) 1-(4-Bromophenyl)-2-[3-(4-bromophenyl)-5-phenyl-4,5-dihydro-5-isoxazolyl]ethanone 1-(4-bromophenyl)-2-[3-(4-bromophenyl)-5-phenyl-2-isoxazolin-5-yl]ethanone 1-(4-bromophenyl)-2-[3-(4-bromophenyl)-5-phenyl-4H-1,2-oxazol-5-yl]ethanone 1-(4-bromophenyl)-2-[3-(4-bromophenyl)-5-phenyl-4H-isoxazol-5-yl]ethanone
CAS Registry Number 21326-93-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17Br2NO2
InChI InChI=1S/C23H17Br2NO2/c24-19-10-6-16(7-11-19)21-14-23(28-26-21,18-4-2-1-3-5-18)15-22(27)17-8-12-20(25)13-9-17/h1-13H,14-15H2
InChIKey KKCIXLIFXAAGLS-UHFFFAOYSA-N
Molecular Weight 499.202 g/mol
SMILES c1ccc(cc1)C1(CC(c2ccc(cc2)Br)=NO1)CC(c1ccc(cc1)Br)=O
SPLASH splash10-0udi-2709000000-714665b3fa167c419eb7
Source of Spectrum W5-36633-28903-28903
Wiley ID 1398383