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3,5-Diphenyl-isoxazole
SpectraBase Compound ID DSVnKKGkIw3
InChI InChI=1S/C15H11NO/c1-3-7-12(8-4-1)14-11-15(17-16-14)13-9-5-2-6-10-13/h1-11H
InChIKey HECRDSFKLUVCAY-UHFFFAOYSA-N
Mol Weight 221.26 g/mol
Molecular Formula C15H11NO
Exact Mass 221.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F40wFcuxPK7
Name 3,5-Diphenylisoxazole
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 221.084063977 u
Formula C15H11NO
InChI InChI=1S/C15H11NO/c1-3-7-12(8-4-1)14-11-15(17-16-14)13-9-5-2-6-10-13/h1-11H
InChIKey HECRDSFKLUVCAY-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jo302770g
Molecular Weight 221.259 g/mol
Quality 298
SMILES C=1(ON=C(C1)C1=CC=CC=C1)C1=CC=CC=C1
SPLASH splash10-0a6r-6920000000-97105d5ffcdc2a38d6f8
Source of Spectrum JOC-78-1636-3a (DOI: 10.1021/jo302770g)
Wiley ID 1912248