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2,2,3-trichlorobutanoic acid
SpectraBase Compound ID 1j8zy8n5meg
InChI InChI=1S/C4H5Cl3O2/c1-2(5)4(6,7)3(8)9/h2H,1H3,(H,8,9)
InChIKey FAXJFVQAGPWKHQ-UHFFFAOYSA-N
Mol Weight 191.44 g/mol
Molecular Formula C4H5Cl3O2
Exact Mass 189.935512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2jc7wm5FIG
Name 2,2,3-trichlorobutanoic acid
Alternate Name(s) 2,2,3-Trichlorobutyric acid 2,2,3-tris(chloranyl)butanoic acid
CAS Registry Number 5344-55-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H5Cl3O2
InChI InChI=1S/C4H5Cl3O2/c1-2(5)4(6,7)3(8)9/h2H,1H3,(H,8,9)
InChIKey FAXJFVQAGPWKHQ-UHFFFAOYSA-N
Molecular Weight 191.441 g/mol
SMILES OC(C(C(C)Cl)(Cl)Cl)=O
SPLASH splash10-004l-9200000000-b06f006123ec7787a7e4
Source of Spectrum RB-1982-11304-0
Wiley ID 90105