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7-(4-[2,2-BIS-(DIETHOXYPHOSPHORYL)-ETHYL]-PIPERIZIN-1-YL)-1-CYCLOPROPYL-6-FLUORO-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC-ACID

View entire compound with spectra: 1 NMR

7-(4-[2,2-BIS-(DIETHOXYPHOSPHORYL)-ETHYL]-PIPERIZIN-1-YL)-1-CYCLOPROPYL-6-FLUORO-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC-ACID
SpectraBase Compound ID 5TSdtYLBpqj
InChI InChI=1S/C27H40FN3O9P2/c1-5-37-41(35,38-6-2)25(42(36,39-7-3)40-8-4)18-29-11-13-30(14-12-29)24-16-23-20(15-22(24)28)26(32)21(27(33)34)17-31(23)19-9-10-19/h15-17,19,25H,5-14,18H2,1-4H3,(H,33,34)
InChIKey ALHYQQOLVDZAGY-UHFFFAOYSA-N
Mol Weight 631.6 g/mol
Molecular Formula C27H40FN3O9P2
Exact Mass 631.222382 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J4MKqBAku02
Name 7-(4-[2,2-BIS-(DIETHOXYPHOSPHORYL)-ETHYL]-PIPERIZIN-1-YL)-1-CYCLOPROPYL-6-FLUORO-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC-ACID
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H40FN3O9P2
InChI InChI=1S/C27H40FN3O9P2/c1-5-37-41(35,38-6-2)25(42(36,39-7-3)40-8-4)18-29-11-13-30(14-12-29)24-16-23-20(15-22(24)28)26(32)21(27(33)34)17-31(23)19-9-10-19/h15-17,19,25H,5-14,18H2,1-4H3,(H,33,34)
InChIKey ALHYQQOLVDZAGY-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 631.575 g/mol
Sample ID 64386
Solvent CDCl3