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7-(4-[2,2-BIS-(DIETHOXYPHOSPHORYL)-ETHYL]-PIPERIZIN-1-YL)-1-ETHYL-6-FLUORO-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC-ACID
SpectraBase Compound ID HzlHTQyc28L
InChI InChI=1S/C26H40FN3O9P2/c1-6-29-17-20(26(32)33)25(31)19-15-21(27)23(16-22(19)29)30-13-11-28(12-14-30)18-24(40(34,36-7-2)37-8-3)41(35,38-9-4)39-10-5/h15-17,24H,6-14,18H2,1-5H3,(H,32,33)
InChIKey USFNKTLYJLNEEE-UHFFFAOYSA-N
Mol Weight 619.6 g/mol
Molecular Formula C26H40FN3O9P2
Exact Mass 619.222382 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1mVx60Djzo6
Name 7-(4-[2,2-BIS-(DIETHOXYPHOSPHORYL)-ETHYL]-PIPERIZIN-1-YL)-1-ETHYL-6-FLUORO-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC-ACID
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H40FN3O9P2
InChI InChI=1S/C26H40FN3O9P2/c1-6-29-17-20(26(32)33)25(31)19-15-21(27)23(16-22(19)29)30-13-11-28(12-14-30)18-24(40(34,36-7-2)37-8-3)41(35,38-9-4)39-10-5/h15-17,24H,6-14,18H2,1-5H3,(H,32,33)
InChIKey USFNKTLYJLNEEE-UHFFFAOYSA-N
Literature Reference Author P.HERCZEGH,T.B.BUXTON,J.C.M.PHERSON,A.KOVACS-KULYASSA,P.D.BR EWER,F.SZTARICSKAI,G
Literature Reference Citation J.MED.CHEM.,45,2338(2002)
Literature Reference DOI 10.1021/jm0105326
Molecular Weight 619.564 g/mol
Sample ID 64388
Solvent CDCl3