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Dimethyl 5-(trifluoromethyl)isophthalate
SpectraBase Compound ID AzQ1HE7pUX7
InChI InChI=1S/C11H9F3O4/c1-17-9(15)6-3-7(10(16)18-2)5-8(4-6)11(12,13)14/h3-5H,1-2H3
InChIKey JIIRKRJNBBUTBR-UHFFFAOYSA-N
Mol Weight 262.18 g/mol
Molecular Formula C11H9F3O4
Exact Mass 262.045293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOjSMcEwZzP
Name Dimethyl 5-(trifluoromethyl)isophthalate
Alternate Name(s) Dimethyl 5-(trifluoromethyl)benzene-1,3-dicarboxylate
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Formula C11H9F3O4
InChI InChI=1S/C11H9F3O4/c1-17-9(15)6-3-7(10(16)18-2)5-8(4-6)11(12,13)14/h3-5H,1-2H3
InChIKey JIIRKRJNBBUTBR-UHFFFAOYSA-N
Molecular Weight 262.184 g/mol
SMILES C(c1cc(C(=O)OC)cc(c1)C(=O)OC)(F)(F)F
SPLASH splash10-001i-0190000000-eab811fbf56ad905c723
Source of Spectrum F4-46-S13-3zn
Wiley ID 1742197