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Dimethyl 2-(benzoyloxy)-3-bromosuccinate
SpectraBase Compound ID 3VlLgJpjLf4
InChI InChI=1S/C13H13BrO6/c1-18-12(16)9(14)10(13(17)19-2)20-11(15)8-6-4-3-5-7-8/h3-7,9-10H,1-2H3
InChIKey PKPAPGSWZFIPKB-UHFFFAOYSA-N
Mol Weight 345.15 g/mol
Molecular Formula C13H13BrO6
Exact Mass 343.989551 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91TzamJdQ7p
Name Dimethyl 2-(benzoyloxy)-3-bromosuccinate
Alternate Name(s) 2-Benzoyloxy-3-bromo-succinic acid dimethyl ester 2-Benzoyloxy-3-bromobutanedioic acid dimethyl ester Dimethyl 2-benzoyloxy-3-bromo-butanedioate Dimethyl 2-bromanyl-3-(phenylcarbonyloxy)butanedioate
CAS Registry Number 79413-91-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13BrO6
InChI InChI=1S/C13H13BrO6/c1-18-12(16)9(14)10(13(17)19-2)20-11(15)8-6-4-3-5-7-8/h3-7,9-10H,1-2H3
InChIKey PKPAPGSWZFIPKB-UHFFFAOYSA-N
Molecular Weight 345.145 g/mol
SMILES COC(=O)C(Br)C(OC(=O)c1ccccc1)C(=O)OC
SPLASH splash10-0a4i-2900000000-d626dca2ac05fdb77468
Source of Spectrum H-64-1476-0
Wiley ID 1337554