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[1,1'-Biphenyl]-2,2'-dicarboxylic acid, 6,6'-dibromo-, dimethyl ester, (.+-.)-
SpectraBase Compound ID CBSbxTYJpqS
InChI InChI=1S/C16H12Br2O4/c1-21-15(19)9-5-3-7-11(17)13(9)14-10(16(20)22-2)6-4-8-12(14)18/h3-8H,1-2H3
InChIKey IJYXCFYJQXEAGV-UHFFFAOYSA-N
Mol Weight 428.08 g/mol
Molecular Formula C16H12Br2O4
Exact Mass 425.910235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I6Iut1uVAsF
Name [1,1'-Biphenyl]-2,2'-dicarboxylic acid, 6,6'-dibromo-, dimethyl ester, (.+-.)-
Alternate Name(s) Dimethyl (RS)-6,6'-dibromobiphenyl-2,2'-dicarboxylate Dimethyl 6,6'-dibromo[1,1'-biphenyl]-2,2'-dicarboxylate 3-Bromo-2-(2-bromo-6-methoxycarbonylphenyl)benzoic acid methyl ester Methyl 3-bromo-2-(2-bromo-6-methoxycarbonylphenyl)benzoate Methyl 3-bromo-2-(2-bromo-6-methoxycarbonyl-phenyl)benzoate Methyl 3-bromanyl-2-(2-bromanyl-6-methoxycarbonyl-phenyl)benzoate
CAS Registry Number 121772-85-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12Br2O4
InChI InChI=1S/C16H12Br2O4/c1-21-15(19)9-5-3-7-11(17)13(9)14-10(16(20)22-2)6-4-8-12(14)18/h3-8H,1-2H3
InChIKey IJYXCFYJQXEAGV-UHFFFAOYSA-N
Molecular Weight 428.076 g/mol
SMILES c1(-c2c(C(=O)OC)cccc2Br)c(C(=O)OC)cccc1Br
SPLASH splash10-0f6t-0049000000-2d6e7c8a18daa7384eae
Source of Spectrum H-71-924-37
Wiley ID 1379774