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N-{5-[2'-(2"-Fluorophenoxy)phenyl]-1,3,4-oxadiazol-2-yl}-N'-phenylurea
SpectraBase Compound ID 654fvfVYi55
InChI InChI=1S/C21H15FN4O3/c22-16-11-5-7-13-18(16)28-17-12-6-4-10-15(17)19-25-26-21(29-19)24-20(27)23-14-8-2-1-3-9-14/h1-13H,(H2,23,24,26,27)
InChIKey XBBBZQOFUGPXNQ-UHFFFAOYSA-N
Mol Weight 390.37 g/mol
Molecular Formula C21H15FN4O3
Exact Mass 390.112819 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ChbWKRzG6jG
Name N-{5-[2'-(2''-Fluorophenoxy)phenyl]-1,3,4-oxadiazol-2-yl}-N'-phenylurea
Comments Computed using HOSE algorithm
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Exact Mass 390.112818519 u
Formula C21H15FN4O3
InChI InChI=1S/C21H15FN4O3/c22-16-11-5-7-13-18(16)28-17-12-6-4-10-15(17)19-25-26-21(29-19)24-20(27)23-14-8-2-1-3-9-14/h1-13H,(H2,23,24,26,27)
InChIKey XBBBZQOFUGPXNQ-UHFFFAOYSA-N
Molecular Weight 390.374 g/mol
SMILES C=1(OC(NC(NC2=CC=CC=C2)=O)=NN1)C=1C(OC=2C(F)=CC=CC2)=CC=CC1