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4-Bromo-benzoic acid
SpectraBase Compound ID FSn21qKDH95
InChI InChI=1S/C7H5BrO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)
InChIKey TUXYZHVUPGXXQG-UHFFFAOYSA-N
Mol Weight 201.02 g/mol
Molecular Formula C7H5BrO2
Exact Mass 199.947292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Izu1UaL8GYs
Name Benzoic acid, 4-bromo-
CAS Registry Number 586-76-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5BrO2
InChI InChI=1S/C7H5BrO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)
InChIKey TUXYZHVUPGXXQG-UHFFFAOYSA-N
Molecular Weight 201.019 g/mol
SMILES OC(c1ccc(cc1)Br)=O
SPLASH splash10-0udi-9750000000-abc3f002fe9b749a40e6
Synonyms 4-Bromanylbenzoic acid 4-Bromo-benzoic acid Benzoic acid, p-bromo- p-Bromobenzenecarboxylic acid p-Bromobenzoic acid p-Carboxybromobenzene AI3-08859 BRN 1906923 EINECS 209-581-7 NSC 17582
Wiley ID 1472595