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1-[5-(4-methoxyphenyl)-2-(3-nitrophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone (autogenerated)
SpectraBase Compound ID 9axSjaQVQM9
InChI InChI=1S/C17H15N3O5/c1-11(21)19-17(13-4-3-5-14(10-13)20(22)23)25-16(18-19)12-6-8-15(24-2)9-7-12/h3-10,17H,1-2H3
InChIKey QWDRRZSMJHPUCA-UHFFFAOYSA-N
Mol Weight 341.32 g/mol
Molecular Formula C17H15N3O5
Exact Mass 341.101171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 83zowDuh9tg
Name 1-[5-(4-methoxyphenyl)-2-(3-nitrophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone (autogenerated)
Appearance Yellow solid
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Formula C17H15N3O5
InChI InChI=1S/C17H15N3O5/c1-11(21)19-17(13-4-3-5-14(10-13)20(22)23)25-16(18-19)12-6-8-15(24-2)9-7-12/h3-10,17H,1-2H3
InChIKey QWDRRZSMJHPUCA-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI positive ion
Literature Reference DOI 10.1021/jm901268n
Molecular Weight 341.323 g/mol
SMILES C(C)(=O)N1C(c2cccc(c2)[N+]([O-])=O)OC(=N1)c1ccc(OC)cc1
SPLASH splash10-000i-0901000000-4be15e567fce79922818
Source of Spectrum AF-53-331-10b
Thin-Layer Chromatography Rf = 0.51 (methanol/chloroform, 2:98)
Wiley ID 1846152