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(4Z)-4-[3-(benzyloxy)benzylidene]-2-(2-bromophenyl)-1,3-oxazol-5(4H)-one
SpectraBase Compound ID ETJHDnkrtRI
InChI InChI=1S/C23H16BrNO3/c24-20-12-5-4-11-19(20)22-25-21(23(26)28-22)14-17-9-6-10-18(13-17)27-15-16-7-2-1-3-8-16/h1-14H,15H2/b21-14-
InChIKey BNFXXAUOGUMVPK-STZFKDTASA-N
Mol Weight 434.29 g/mol
Molecular Formula C23H16BrNO3
Exact Mass 433.031356 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1fbu3MqVBqM
Name (4Z)-4-[3-(Benzyloxy)benzylidene]-2-(2-bromophenyl)-1,3-oxazol-5(4H)-one
Comments Computed using HOSE algorithm
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Exact Mass 433.031356376 u
Formula C23H16BrNO3
InChI InChI=1S/C23H16BrNO3/c24-20-12-5-4-11-19(20)22-25-21(23(26)28-22)14-17-9-6-10-18(13-17)27-15-16-7-2-1-3-8-16/h1-14H,15H2/b21-14-
InChIKey BNFXXAUOGUMVPK-STZFKDTASA-N
Molecular Weight 434.289 g/mol
SMILES C1(=N\C(=C/C2=CC(OCC=3C=CC=CC3)=CC=C2)C(O1)=O)C=1C(Br)=CC=CC1