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2'-benzoyl-5'-fluoro-biphenyl-4-carboxylic acid ethyl ester
SpectraBase Compound ID CaZI6xYDBN6
InChI InChI=1S/C22H17FO3/c1-2-26-22(25)17-10-8-15(9-11-17)20-14-18(23)12-13-19(20)21(24)16-6-4-3-5-7-16/h3-14H,2H2,1H3
InChIKey WSPMZMPAGMBVEQ-UHFFFAOYSA-N
Mol Weight 348.37 g/mol
Molecular Formula C22H17FO3
Exact Mass 348.116173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID T4I0D3gnrM
Name 2'-benzoyl-5'-fluoro-biphenyl-4-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 2'-benzoyl-5'-fluoro-[1,1'-biphenyl]-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17FO3
InChI InChI=1S/C22H17FO3/c1-2-26-22(25)17-10-8-15(9-11-17)20-14-18(23)12-13-19(20)21(24)16-6-4-3-5-7-16/h3-14H,2H2,1H3
InChIKey WSPMZMPAGMBVEQ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol802118e
Molecular Weight 348.373 g/mol
SMILES c1c(c(C(c2ccccc2)=O)ccc1F)-c1ccc(C(OCC)=O)cc1
SPLASH splash10-0002-0349000000-12b03d3161268caac0c7
Source of Spectrum A1-10-4705/SM11-4m
Wiley ID 1760025