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3-Bromo-2,5,6-trifluorobenzoic acid
SpectraBase Compound ID 5corIGvgJos
InChI InChI=1S/C7H2BrF3O2/c8-2-1-3(9)6(11)4(5(2)10)7(12)13/h1H,(H,12,13)
InChIKey IKADJZHHXKPMAH-UHFFFAOYSA-N
Mol Weight 254.99 g/mol
Molecular Formula C7H2BrF3O2
Exact Mass 253.919027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HpTBtGW9GWf
Name 3-Bromo-2,5,6-trifluorobenzoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C7H2BrF3O2
InChI InChI=1S/C7H2BrF3O2/c8-2-1-3(9)6(11)4(5(2)10)7(12)13/h1H,(H,12,13)
InChIKey IKADJZHHXKPMAH-UHFFFAOYSA-N
Molecular Weight 254.990 g/mol
SMILES OC(c1c(c(cc(c1F)F)Br)F)=O
SPLASH splash10-0zfr-0090000000-65c5684a72ee52066a29
Source of Spectrum F2-35-365-11
Synonyms 3-bromanyl-2,5,6-tris(fluoranyl)benzoic acid
Wiley ID 1574246