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2,5-Dichlorobenzoic acid
SpectraBase Compound ID BSeFktzmZYS
InChI InChI=1S/C7H4Cl2O2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H,10,11)
InChIKey QVTQYSFCFOGITD-UHFFFAOYSA-N
Mol Weight 191.01 g/mol
Molecular Formula C7H4Cl2O2
Exact Mass 189.958835 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JVyGCJhvFI6
Name Benzoic acid, 2,5-dichloro-
CAS Registry Number 50-79-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4Cl2O2
InChI InChI=1S/C7H4Cl2O2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H,10,11)
InChIKey QVTQYSFCFOGITD-UHFFFAOYSA-N
Molecular Weight 191.013 g/mol
SMILES OC(=O)c1c(Cl)ccc(c1)Cl
SPLASH splash10-0096-1900000000-037481670025b41cb3a3
Source of Spectrum W5-0-0-0
Synonyms 2,5-bis(chloranyl)benzoic acid 2,5-Dichlorobenzoate 2,5-Dichlorobenzoic acid AI3-33415 BRN 0973353 EINECS 200-065-7 NSC 41889
Wiley ID 1186048