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3-Trifluoromethylbenzoic acid, 2-bromo-4-fluorophenyl ester
SpectraBase Compound ID BOVSbxk20ZG
InChI InChI=1S/C14H7BrF4O2/c15-11-7-10(16)4-5-12(11)21-13(20)8-2-1-3-9(6-8)14(17,18)19/h1-7H
InChIKey ORSKOPILQLSQCZ-UHFFFAOYSA-N
Mol Weight 363.11 g/mol
Molecular Formula C14H7BrF4O2
Exact Mass 361.956555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNTQdMjaIDf
Name 3-Trifluoromethylbenzoic acid, 2-bromo-4-fluorophenyl ester
Alternate Name(s) 3-(trifluoromethyl)benzoic acid (2-bromo-4-fluorophenyl) ester (2-bromo-4-fluorophenyl) 3-(trifluoromethyl)benzoate (2-bromo-4-fluoro-phenyl) 3-(trifluoromethyl)benzoate (2-bromanyl-4-fluoranyl-phenyl) 3-(trifluoromethyl)benzoate
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Formula C14H7BrF4O2
InChI InChI=1S/C14H7BrF4O2/c15-11-7-10(16)4-5-12(11)21-13(20)8-2-1-3-9(6-8)14(17,18)19/h1-7H
InChIKey ORSKOPILQLSQCZ-UHFFFAOYSA-N
Molecular Weight 363.106 g/mol
SMILES c1c(cc(cc1)C(Oc1ccc(cc1Br)F)=O)C(F)(F)F
SPLASH splash10-00di-0900000000-2009467ef53b478e1c68
Source of Spectrum NP-13-1938-0
Wiley ID 1110878