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Propenoic acid, 3-(4-chlorophenyl)-, 2-(4-bromophenyl)-2-oxoethyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Propenoic acid, 3-(4-chlorophenyl)-, 2-(4-bromophenyl)-2-oxoethyl ester
SpectraBase Compound ID 5ZPTEQ7LPwG
InChI InChI=1S/C17H12BrClO3/c18-14-6-4-13(5-7-14)16(20)11-22-17(21)10-3-12-1-8-15(19)9-2-12/h1-10H,11H2/b10-3+
InChIKey VAUDYQDLKFEOCJ-XCVCLJGOSA-N
Mol Weight 379.64 g/mol
Molecular Formula C17H12BrClO3
Exact Mass 377.965835 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DRlXObMXHJP
Name Propenoic acid, 3-(4-chlorophenyl)-, 2-(4-bromophenyl)-2-oxoethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 377.965834943 u
Formula C17H12BrClO3
InChI InChI=1S/C17H12BrClO3/c18-14-6-4-13(5-7-14)16(20)11-22-17(21)10-3-12-1-8-15(19)9-2-12/h1-10H,11H2/b10-3+
InChIKey VAUDYQDLKFEOCJ-XCVCLJGOSA-N
Molecular Weight 379.637 g/mol
SMILES C(\C=C\C1=CC=C(C=C1)Cl)(OCC(C1=CC=C(C=C1)Br)=O)=O