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2-Trifluoromethylbenzoic acid, 3,5-dimethylphenyl ester
SpectraBase Compound ID Cq9B4x6RBkG
InChI InChI=1S/C16H13F3O2/c1-10-7-11(2)9-12(8-10)21-15(20)13-5-3-4-6-14(13)16(17,18)19/h3-9H,1-2H3
InChIKey OHUUJJZOHADYAG-UHFFFAOYSA-N
Mol Weight 294.27 g/mol
Molecular Formula C16H13F3O2
Exact Mass 294.086764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F2n3Wb3vOhb
Name 2-Trifluoromethylbenzoic acid, 3,5-dimethylphenyl ester
Alternate Name(s) (3,5-dimethylphenyl) 2-(trifluoromethyl)benzoate
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Formula C16H13F3O2
InChI InChI=1S/C16H13F3O2/c1-10-7-11(2)9-12(8-10)21-15(20)13-5-3-4-6-14(13)16(17,18)19/h3-9H,1-2H3
InChIKey OHUUJJZOHADYAG-UHFFFAOYSA-N
Molecular Weight 294.273 g/mol
SMILES c1ccc(c(c1)C(Oc1cc(C)cc(C)c1)=O)C(F)(F)F
SPLASH splash10-00di-0910000000-8b0325e4e410e61256a3
Source of Spectrum NP-9-7374-0
Wiley ID 1108336