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[[4-(2-[4-[(DIETHOXYPHOSPHORYL)-DIFLUOROMETHYL]-BENZYLOXY]-ETHOXYMETHYL)-PHENYL]-DIFLUOROMETHYL]-PHOSPHONIC-ACID-DIETHYLESTER

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[[4-(2-[4-[(DIETHOXYPHOSPHORYL)-DIFLUOROMETHYL]-BENZYLOXY]-ETHOXYMETHYL)-PHENYL]-DIFLUOROMETHYL]-PHOSPHONIC-ACID-DIETHYLESTER
SpectraBase Compound ID AcT1DyzPIUp
InChI InChI=1S/C26H36F4O8P2/c1-5-35-39(31,36-6-2)25(27,28)23-13-9-21(10-14-23)19-33-17-18-34-20-22-11-15-24(16-12-22)26(29,30)40(32,37-7-3)38-8-4/h9-16H,5-8,17-20H2,1-4H3
InChIKey WFJZGHCUFHQKOT-UHFFFAOYSA-N
Mol Weight 614.5 g/mol
Molecular Formula C26H36F4O8P2
Exact Mass 614.182155 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2SrzcrwlhYH
Name [[4-(2-[4-[(DIETHOXYPHOSPHORYL)-DIFLUOROMETHYL]-BENZYLOXY]-ETHOXYMETHYL)-PHENYL]-DIFLUOROMETHYL]-PHOSPHONIC-ACID-DIETHYLESTER
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H36F4O8P2
InChI InChI=1S/C26H36F4O8P2/c1-5-35-39(31,36-6-2)25(27,28)23-13-9-21(10-14-23)19-33-17-18-34-20-22-11-15-24(16-12-22)26(29,30)40(32,37-7-3)38-8-4/h9-16H,5-8,17-20H2,1-4H3
InChIKey WFJZGHCUFHQKOT-UHFFFAOYSA-N
Literature Reference Author Z.JIA,Q.YE,A.N.DINAUT,Q.WANG,D.WADDLETON,P.PAYETTE,C.RAMACHA NDRAN,B.KENNEDY,G.HU
Literature Reference Citation J.MED.CHEM.,44,4584(2001)
Literature Reference DOI 10.1021/jm010266w
Molecular Weight 614.508 g/mol
Sample ID 45225
Solvent CDCl3