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Succinic acid, 3-chlorophenyl 4-bromo-2-methoxyphenyl ester

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Succinic acid, 3-chlorophenyl 4-bromo-2-methoxyphenyl ester
SpectraBase Compound ID KnAAm71Spba
InChI InChI=1S/C17H14BrClO5/c1-22-15-9-11(18)5-6-14(15)24-17(21)8-7-16(20)23-13-4-2-3-12(19)10-13/h2-6,9-10H,7-8H2,1H3
InChIKey FVVWPENVVJYCDT-UHFFFAOYSA-N
Mol Weight 413.65 g/mol
Molecular Formula C17H14BrClO5
Exact Mass 411.971314 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EkraBaL8e43
Name Succinic acid, 3-chlorophenyl 4-bromo-2-methoxyphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 411.971314246 u
Formula C17H14BrClO5
InChI InChI=1S/C17H14BrClO5/c1-22-15-9-11(18)5-6-14(15)24-17(21)8-7-16(20)23-13-4-2-3-12(19)10-13/h2-6,9-10H,7-8H2,1H3
InChIKey FVVWPENVVJYCDT-UHFFFAOYSA-N
Molecular Weight 413.651 g/mol
SMILES C(CC(OC1=CC(=CC=C1)Cl)=O)C(OC1=C(C=C(C=C1)Br)OC)=O