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(4Z)-4-(4-ethoxybenzylidene)-2-(2-fluorophenyl)-1,3-oxazol-5(4H)-one
SpectraBase Compound ID JilUwvgKImj
InChI InChI=1S/C18H14FNO3/c1-2-22-13-9-7-12(8-10-13)11-16-18(21)23-17(20-16)14-5-3-4-6-15(14)19/h3-11H,2H2,1H3/b16-11-
InChIKey PNNUBWKIHOHFFY-WJDWOHSUSA-N
Mol Weight 311.31 g/mol
Molecular Formula C18H14FNO3
Exact Mass 311.095771 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DameWR4MYy8
Name (4Z)-4-(4-Ethoxybenzylidene)-2-(2-fluorophenyl)-1,3-oxazol-5(4H)-one
Comments Computed using HOSE algorithm
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Exact Mass 311.095771475 u
Formula C18H14FNO3
InChI InChI=1S/C18H14FNO3/c1-2-22-13-9-7-12(8-10-13)11-16-18(21)23-17(20-16)14-5-3-4-6-15(14)19/h3-11H,2H2,1H3/b16-11-
InChIKey PNNUBWKIHOHFFY-WJDWOHSUSA-N
Molecular Weight 311.312 g/mol
SMILES C1(=N\C(=C/C2=CC=C(C=C2)OCC)C(O1)=O)C1=C(F)C=CC=C1