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2,4,5-trichlorobenzoic acid
SpectraBase Compound ID IaGDNOe5BOx
InChI InChI=1S/C7H3Cl3O2/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2H,(H,11,12)
InChIKey PTFNNDHASFGWFI-UHFFFAOYSA-N
Mol Weight 225.46 g/mol
Molecular Formula C7H3Cl3O2
Exact Mass 223.919862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Afzg454UpOz
Name Benzoic acid, 2,4,5-trichloro-
Alternate Name(s) 2,4,5-Trichlorobenzoic Acid 2,4,5-tris(chloranyl)benzoic acid AI3-33332 BRN 1871922
CAS Registry Number 50-82-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3Cl3O2
InChI InChI=1S/C7H3Cl3O2/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2H,(H,11,12)
InChIKey PTFNNDHASFGWFI-UHFFFAOYSA-N
Molecular Weight 225.458 g/mol
SMILES OC(c1cc(c(cc1Cl)Cl)Cl)=O
SPLASH splash10-05fr-9310000000-36e920cf8f04ec08e870
Source of Spectrum W5-18934-0-0
Wiley ID 1224373