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4-Chlorobenzoic acid 1-(4-Bromophenyl)-2-ethoxycarbonyl-1-methylpropyl ester
SpectraBase Compound ID L9VjROAhWGn
InChI InChI=1S/C20H20BrClO4/c1-4-25-18(23)13(2)20(3,15-7-9-16(21)10-8-15)26-19(24)14-5-11-17(22)12-6-14/h5-13H,4H2,1-3H3
InChIKey WONDJMLGJKQTRB-UHFFFAOYSA-N
Mol Weight 439.73 g/mol
Molecular Formula C20H20BrClO4
Exact Mass 438.02335 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ETZzsH86pod
Name 4-Chlorobenzoic acid 1-(4-Bromophenyl)-2-ethoxycarbonyl-1-methylpropyl ester
Alternate Name(s) 1-(4-bromophenyl)-3-ethoxy-1,2-dimethyl-3-oxopropyl 4-chlorobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20BrClO4
InChI InChI=1S/C20H20BrClO4/c1-4-25-18(23)13(2)20(3,15-7-9-16(21)10-8-15)26-19(24)14-5-11-17(22)12-6-14/h5-13H,4H2,1-3H3
InChIKey WONDJMLGJKQTRB-UHFFFAOYSA-N
Molecular Weight 439.733 g/mol
SMILES C(c1ccc(cc1)Cl)(=O)OC(C(C)C(=O)OCC)(C)c1ccc(cc1)Br
SPLASH splash10-000i-0900000000-4a430b47584cc4cb6102
Source of Spectrum F-70-10416-7
Wiley ID 1598063