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3-Fluoro-biphenyl-2,4'-dicarboxylic acid diethyl ester
SpectraBase Compound ID At9OBmVzuKU
InChI InChI=1S/C18H17FO4/c1-3-22-17(20)13-10-8-12(9-11-13)14-6-5-7-15(19)16(14)18(21)23-4-2/h5-11H,3-4H2,1-2H3
InChIKey TYTSQOPNFPTJTD-UHFFFAOYSA-N
Mol Weight 316.33 g/mol
Molecular Formula C18H17FO4
Exact Mass 316.111087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FsYwDmJ2tUm
Name 3-Fluoro-biphenyl-2,4'-dicarboxylic acid diethyl ester
Alternate Name(s) Diethyl 3-fluoro-[1,1'-biphenyl]-2,4'-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17FO4
InChI InChI=1S/C18H17FO4/c1-3-22-17(20)13-10-8-12(9-11-13)14-6-5-7-15(19)16(14)18(21)23-4-2/h5-11H,3-4H2,1-2H3
InChIKey TYTSQOPNFPTJTD-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol802118e
Molecular Weight 316.328 g/mol
SMILES c1(c(c(F)ccc1)C(OCC)=O)-c1ccc(cc1)C(=O)OCC
SPLASH splash10-00dl-5593000000-294143c6180032fe1713
Source of Spectrum A1-10-4705/SM7-4g
Wiley ID 1760021