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4-Phenyl-6-(trifluoromethyl)benzene-1,3-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 26maQRBaKk9
InChI InChI=1S/C17H13F3O4/c1-23-15(21)12-8-13(16(22)24-2)14(17(18,19)20)9-11(12)10-6-4-3-5-7-10/h3-9H,1-2H3
InChIKey BBVNGIIGURYKFT-UHFFFAOYSA-N
Mol Weight 338.28 g/mol
Molecular Formula C17H13F3O4
Exact Mass 338.076593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FEOi9woIFr
Name 4-Phenyl-6-(trifluoromethyl)benzene-1,3-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl 4-phenyl-6-(trifluoromethyl)benzene-1,3-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13F3O4
InChI InChI=1S/C17H13F3O4/c1-23-15(21)12-8-13(16(22)24-2)14(17(18,19)20)9-11(12)10-6-4-3-5-7-10/h3-9H,1-2H3
InChIKey BBVNGIIGURYKFT-UHFFFAOYSA-N
Molecular Weight 338.282 g/mol
SMILES c1(c(cc(c(c1)-c1ccccc1)C(=O)OC)C(=O)OC)C(F)(F)F
SPLASH splash10-0a4r-1009000000-5dcb56a40a4ce63c8acb
Source of Spectrum KC-1993-858-7
Wiley ID 779353