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3''-Hydroxy-2''-methyl-5''-(trifluoromethyl)[1,1':4',1'']terphenyl-4''-carboxylic acid methyl ester
SpectraBase Compound ID 3i6uO9bQNDR
InChI InChI=1S/C22H17F3O3/c1-13-17(12-18(22(23,24)25)19(20(13)26)21(27)28-2)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-12,26H,1-2H3
InChIKey RSGCYTMJRJNLMI-UHFFFAOYSA-N
Mol Weight 386.37 g/mol
Molecular Formula C22H17F3O3
Exact Mass 386.112979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6usVxZxOO3r
Name 3''-Hydroxy-2''-methyl-5''-(trifluoromethyl)[1,1':4',1'']terphenyl-4''-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17F3O3
InChI InChI=1S/C22H17F3O3/c1-13-17(12-18(22(23,24)25)19(20(13)26)21(27)28-2)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-12,26H,1-2H3
InChIKey RSGCYTMJRJNLMI-UHFFFAOYSA-N
Molecular Weight 386.370 g/mol
SMILES Oc1c(c(C(F)(F)F)cc(c1C)-c1ccc(cc1)-c1ccccc1)C(=O)OC
SPLASH splash10-0f9i-0039000000-95dd8cf606b6f717704b
Source of Spectrum F-65-2134-5am
Wiley ID 1681706