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1-(p-Phenoxyphenyl)-3-[5'-(2"-acetoxyphenyl)-1',3',4'-oxadiazol-2'-yl]propan-1-one
SpectraBase Compound ID 70zOsW9J0Ly
InChI InChI=1S/C25H20N2O5/c1-17(28)30-23-10-6-5-9-21(23)25-27-26-24(32-25)16-15-22(29)18-11-13-20(14-12-18)31-19-7-3-2-4-8-19/h2-14H,15-16H2,1H3
InChIKey LELPDFGVYFUPKD-UHFFFAOYSA-N
Mol Weight 428.44 g/mol
Molecular Formula C25H20N2O5
Exact Mass 428.137222 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5AmWbigpvGe
Name 1-(p-Phenoxyphenyl)-3-[5'-(2''-acetoxyphenyl)-1',3',4'-oxadiazol-2'-yl]propan-1-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 428.137221747 u
Formula C25H20N2O5
InChI InChI=1S/C25H20N2O5/c1-17(28)30-23-10-6-5-9-21(23)25-27-26-24(32-25)16-15-22(29)18-11-13-20(14-12-18)31-19-7-3-2-4-8-19/h2-14H,15-16H2,1H3
InChIKey LELPDFGVYFUPKD-UHFFFAOYSA-N
Molecular Weight 428.444 g/mol
SMILES C1(=NN=C(O1)CCC(C=1C=CC(OC=2C=CC=CC2)=CC1)=O)C=1C(OC(=O)C)=CC=CC1