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2-(4-Bromophenyl)propanoic acid
SpectraBase Compound ID DfCpTeTGOsk
InChI InChI=1S/C9H9BrO2/c1-6(9(11)12)7-2-4-8(10)5-3-7/h2-6H,1H3,(H,11,12)
InChIKey PFDBEACWLCHWRZ-UHFFFAOYSA-N
Mol Weight 229.07 g/mol
Molecular Formula C9H9BrO2
Exact Mass 227.978593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3dyQCf0pXXI
Name 2-(4-Bromophenyl)propanoic acid
CAS Registry Number 53086-53-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9BrO2
InChI InChI=1S/C9H9BrO2/c1-6(9(11)12)7-2-4-8(10)5-3-7/h2-6H,1H3,(H,11,12)
InChIKey PFDBEACWLCHWRZ-UHFFFAOYSA-N
Molecular Weight 229.073 g/mol
SMILES OC(C(c1ccc(cc1)Br)C)=O
SPLASH splash10-0ugr-3910000000-8e2627fa04c76a4a204c
Synonyms 2-(4-Bromophenyl)propionic acid Benzeneacetic acid, 4-bromo-.alpha.-methyl-
Wiley ID 1496328