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(E)-Butyl 3-(2-(bis(4-fluorophenyl)phosphoryl)-5-fluorophenyl)acrylate
SpectraBase Compound ID 6487RVQS76x
InChI InChI=1S/C25H22F3O3P/c1-2-3-16-31-25(29)15-4-18-17-21(28)9-14-24(18)32(30,22-10-5-19(26)6-11-22)23-12-7-20(27)8-13-23/h4-15,17H,2-3,16H2,1H3/b15-4+
InChIKey COTNFOGEUYKYDC-SYZQJQIISA-N
Mol Weight 458.42 g/mol
Molecular Formula C25H22F3O3P
Exact Mass 458.125866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Gs4qmsocrf
Name (E)-Butyl 3-(2-(bis(4-fluorophenyl)phosphoryl)-5-fluorophenyl)acrylate
Alternate Name(s) Butyl (E)-3-(2-(bis(4-fluorophenyl)phosphoryl)-5-fluorophenyl)acrylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22F3O3P
InChI InChI=1S/C25H22F3O3P/c1-2-3-16-31-25(29)15-4-18-17-21(28)9-14-24(18)32(30,22-10-5-19(26)6-11-22)23-12-7-20(27)8-13-23/h4-15,17H,2-3,16H2,1H3/b15-4+
InChIKey COTNFOGEUYKYDC-SYZQJQIISA-N
Literature Reference DOI 10.1002/cctc.201700557
Molecular Weight 458.417 g/mol
SMILES c1(P(=O)(c2c(cc(cc2)F)\C=C\C(OCCCC)=O)c2ccc(cc2)F)ccc(cc1)F
SPLASH splash10-0a4i-1039000000-23272eece381cb90e1ad
Source of Spectrum CCC-9-3117/SM12-4da
Wiley ID 1808097