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4-Bromo-3-(1,3-dioxolan-2-yl)benzoic acid ethyl ester
SpectraBase Compound ID Bvnl0GY8usT
InChI InChI=1S/C12H13BrO4/c1-2-15-11(14)8-3-4-10(13)9(7-8)12-16-5-6-17-12/h3-4,7,12H,2,5-6H2,1H3
InChIKey KVDKXZLVANLODV-UHFFFAOYSA-N
Mol Weight 301.14 g/mol
Molecular Formula C12H13BrO4
Exact Mass 299.999722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2PVQQN6kTu7
Name 4-Bromo-3-(1,3-dioxolan-2-yl)benzoic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13BrO4
InChI InChI=1S/C12H13BrO4/c1-2-15-11(14)8-3-4-10(13)9(7-8)12-16-5-6-17-12/h3-4,7,12H,2,5-6H2,1H3
InChIKey KVDKXZLVANLODV-UHFFFAOYSA-N
Molecular Weight 301.136 g/mol
SMILES c1(cc(C(=O)OCC)ccc1Br)C1OCCO1
SPLASH splash10-00di-9062000000-aa55fd02db560647a1ae
Source of Spectrum F-50-11350-12
Synonyms Ethyl 4-bromanyl-3-(1,3-dioxolan-2-yl)benzoate Ethyl 4-bromo-3-(1,3-dioxolan-2-yl)benzoate
Wiley ID 789499