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Methyl 3-(2-bromoethoxy)benzoate
SpectraBase Compound ID EJoIC7BJxk7
InChI InChI=1S/C10H11BrO3/c1-13-10(12)8-3-2-4-9(7-8)14-6-5-11/h2-4,7H,5-6H2,1H3
InChIKey CGGLKWTURIUCMN-UHFFFAOYSA-N
Mol Weight 259.1 g/mol
Molecular Formula C10H11BrO3
Exact Mass 257.989157 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GogXkH7DMz1
Name Methyl 3-(2-bromoethoxy)benzoate
Appearance Colorless oil
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Formula C10H11BrO3
InChI InChI=1S/C10H11BrO3/c1-13-10(12)8-3-2-4-9(7-8)14-6-5-11/h2-4,7H,5-6H2,1H3
InChIKey CGGLKWTURIUCMN-UHFFFAOYSA-N
Instrument Name Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.1021/acsmedchemlett.7b00100
Molecular Weight 259.099 g/mol
Reported Formula C10H11BrO3
SMILES c1c(cccc1C(=O)OC)OCCBr
SPLASH splash10-00di-1910000000-7c1aefb3472625ed10e3
Source of Spectrum MCS-8-SM11-9p
Thin-Layer Chromatography Rf = 0.44 (CH/EE, 4:1)
Wiley ID 1870736