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Bis[2-(4-bromophenyl)-2-oxoethyl] 2-methylenesuccinate
SpectraBase Compound ID 3YVWQM82ZLE
InChI InChI=1S/C21H16Br2O6/c1-13(21(27)29-12-19(25)15-4-8-17(23)9-5-15)10-20(26)28-11-18(24)14-2-6-16(22)7-3-14/h2-9H,1,10-12H2
InChIKey XZPBUGYPEHGASC-UHFFFAOYSA-N
Mol Weight 524.16 g/mol
Molecular Formula C21H16Br2O6
Exact Mass 521.931364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IwqxIEmzRp6
Name Bis[2-(4-bromophenyl)-2-oxoethyl] 2-methylenesuccinate
Alternate Name(s) Butanedioic acid, 2-methylene-, bis[2-oxo-2-(4-bromophenyl)ethyl ester] p-Bromophenacyl itaconate Succinic acid, methylene-, bis(p-bromophenacyl) ester 2-Methylenebutanedioic acid bis[2-(4-bromophenyl)-2-oxoethyl] ester bis[2-(4-bromophenyl)-2-oxoethyl] 2-methylidenebutanedioate bis[2-(4-bromophenyl)-2-oxo-ethyl] 2-methylenebutanedioate bis[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-methylidenebutanedioate
CAS Registry Number 73926-97-3
Comments Note: The molecular formula of the structure shown is C21H16Br2O6 - which differs from the formula reported for the mass spectrum (C21H15DBr2O6)
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Formula C21H15DBr2O6
InChI InChI=1S/C21H16Br2O6/c1-13(21(27)29-12-19(25)15-4-8-17(23)9-5-15)10-20(26)28-11-18(24)14-2-6-16(22)7-3-14/h2-9H,1,10-12H2
InChIKey XZPBUGYPEHGASC-UHFFFAOYSA-N
Molecular Weight 524.161 g/mol
SMILES C(CC(=O)OCC(=O)c1ccc(cc1)Br)(=C)C(=O)OCC(=O)c1ccc(cc1)Br
SPLASH splash10-053i-5900000000-a36d3d9e0130fbd118f2
Wiley ID 1480043