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5-(bromomethyl)-1,3-benzodioxole-4-carboxylic acid ethyl ester
SpectraBase Compound ID HGJSDt6XOgE
InChI InChI=1S/C11H11BrO4/c1-2-14-11(13)9-7(5-12)3-4-8-10(9)16-6-15-8/h3-4H,2,5-6H2,1H3
InChIKey DJUWSQFISSJQJR-UHFFFAOYSA-N
Mol Weight 287.11 g/mol
Molecular Formula C11H11BrO4
Exact Mass 285.984072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Da2Etj7NLs1
Name 5-(bromomethyl)-1,3-benzodioxole-4-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 5-(bromomethyl)-1,3-benzodioxole-4-carboxylate
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Formula C11H11BrO4
InChI InChI=1S/C11H11BrO4/c1-2-14-11(13)9-7(5-12)3-4-8-10(9)16-6-15-8/h3-4H,2,5-6H2,1H3
InChIKey DJUWSQFISSJQJR-UHFFFAOYSA-N
Molecular Weight 287.109 g/mol
SMILES C(c1c2c(ccc1CBr)OCO2)(=O)OCC
SPLASH splash10-056s-0940000000-beece09636d30167ccc6
Source of Spectrum F-55-4453-6
Wiley ID 837551