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(4Z)-4-{4-[(4-fluorobenzyl)oxy]benzylidene}-2-(2-fluorophenyl)-1,3-oxazol-5(4H)-one
SpectraBase Compound ID KAXOTEFVCm9
InChI InChI=1S/C23H15F2NO3/c24-17-9-5-16(6-10-17)14-28-18-11-7-15(8-12-18)13-21-23(27)29-22(26-21)19-3-1-2-4-20(19)25/h1-13H,14H2/b21-13-
InChIKey DOXRVASAEKSWAY-BKUYFWCQSA-N
Mol Weight 391.37 g/mol
Molecular Formula C23H15F2NO3
Exact Mass 391.102 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1mrG1adk5Kf
Name (4Z)-4-{4-[(4-Fluorobenzyl)oxy]benzylidene}-2-(2-fluorophenyl)-1,3-oxazol-5(4H)-one
Comments Computed using HOSE algorithm
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Exact Mass 391.101999670 u
Formula C23H15F2NO3
InChI InChI=1S/C23H15F2NO3/c24-17-9-5-16(6-10-17)14-28-18-11-7-15(8-12-18)13-21-23(27)29-22(26-21)19-3-1-2-4-20(19)25/h1-13H,14H2/b21-13-
InChIKey DOXRVASAEKSWAY-BKUYFWCQSA-N
Molecular Weight 391.374 g/mol
SMILES C1(=N\C(=C/C=2C=CC(OCC3=CC=C(C=C3)F)=CC2)C(O1)=O)C=1C(F)=CC=CC1