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1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone (autogenerated)
SpectraBase Compound ID KoV85cEPFLW
InChI InChI=1S/C17H15N3O5/c1-11(21)19-17(13-3-7-14(8-4-13)20(22)23)25-16(18-19)12-5-9-15(24-2)10-6-12/h3-10,17H,1-2H3
InChIKey LYXGBTQPFJRATQ-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 B8aPOHjUAGV
Name 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone (autogenerated)
Appearance Yellow powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15N3O5
InChI InChI=1S/C17H15N3O5/c1-11(21)19-17(13-3-7-14(8-4-13)20(22)23)25-16(18-19)12-5-9-15(24-2)10-6-12/h3-10,17H,1-2H3
InChIKey LYXGBTQPFJRATQ-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI positive ion
Literature Reference DOI 10.1021/jm901268n
Molecular Weight 341.323 g/mol
SMILES c1([N+](=O)[O-])ccc(cc1)C1OC(=NN1C(=O)C)c1ccc(OC)cc1
SPLASH splash10-000i-0901000000-4be15e567fce79922818
Source of Spectrum AF-53-331-10a
Thin-Layer Chromatography Rf = 0.69 (methanol/chloroform, 2:98)
Wiley ID 1846151