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5-Bromo-1,3-benzenediacetic Acid
SpectraBase Compound ID 35SbPo5FHDL
InChI InChI=1S/C10H9BrO4/c11-8-2-6(4-9(12)13)1-7(3-8)5-10(14)15/h1-3H,4-5H2,(H,12,13)(H,14,15)
InChIKey XWBCRKXBZYZKJW-UHFFFAOYSA-N
Mol Weight 273.08 g/mol
Molecular Formula C10H9BrO4
Exact Mass 271.968422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AOPww5xMhOJ
Name 5-Bromo-1,3-benzenediacetic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9BrO4
InChI InChI=1S/C10H9BrO4/c11-8-2-6(4-9(12)13)1-7(3-8)5-10(14)15/h1-3H,4-5H2,(H,12,13)(H,14,15)
InChIKey XWBCRKXBZYZKJW-UHFFFAOYSA-N
Molecular Weight 273.082 g/mol
SMILES OC(Cc1cc(CC(=O)O)cc(c1)Br)=O
SPLASH splash10-008a-0970000000-3c3e4e7fe9f4ff707c19
Source of Spectrum C-119-7299-3
Synonyms [3-bromo-5-(carboxymethyl)phenyl]acetic acid
Wiley ID 760444