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2-[(4-Chlorophenyl)ethynyl]-4-hydroxy-5-phenyl-6H-1,3-oxazin-6-one
SpectraBase Compound ID Bmlb0HZO7FE
InChI InChI=1S/C18H10ClNO3/c19-14-9-6-12(7-10-14)8-11-15-20-17(21)16(18(22)23-15)13-4-2-1-3-5-13/h1-7,9-10,21H
InChIKey RIEPXMMOBVNTFR-UHFFFAOYSA-N
Mol Weight 323.74 g/mol
Molecular Formula C18H10ClNO3
Exact Mass 323.034921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gy5Qhf87oYC
Name 2-[(4-Chlorophenyl)ethynyl]-4-hydroxy-5-phenyl-6H-1,3-oxazin-6-one
Appearance Yellow crystals
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Formula C18H10ClNO3
InChI InChI=1S/C18H10ClNO3/c19-14-9-6-12(7-10-14)8-11-15-20-17(21)16(18(22)23-15)13-4-2-1-3-5-13/h1-7,9-10,21H
InChIKey RIEPXMMOBVNTFR-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 323.735 g/mol
SMILES OC1=C(C(OC(C#Cc2ccc(Cl)cc2)=N1)=O)c1ccccc1
SPLASH splash10-044i-3943000000-67606b7bec2477dd26f9
Source of Spectrum WO2016020732A1
Wiley ID 1851069