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Trimethylsilyl 6,8-difluoro-1-(2-fluoroethyl)-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylate
SpectraBase Compound ID LNlXO7J9WxS
InChI InChI=1S/C20H26F3N3O3Si/c1-24-7-9-25(10-8-24)18-15(22)11-13-17(16(18)23)26(6-5-21)12-14(19(13)27)20(28)29-30(2,3)4/h11-12H,5-10H2,1-4H3
InChIKey RZVPZWXTHUPKDC-UHFFFAOYSA-N
Mol Weight 441.53 g/mol
Molecular Formula C20H26F3N3O3Si
Exact Mass 441.169553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ILebslCsjdB
Name Trimethylsilyl 6,8-difluoro-1-(2-fluoroethyl)-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 441.169552730 u
Formula C20H26F3N3O3Si
InChI InChI=1S/C20H26F3N3O3Si/c1-24-7-9-25(10-8-24)18-15(22)11-13-17(16(18)23)26(6-5-21)12-14(19(13)27)20(28)29-30(2,3)4/h11-12H,5-10H2,1-4H3
InChIKey RZVPZWXTHUPKDC-UHFFFAOYSA-N
Molecular Weight 441.526 g/mol
SMILES CN1CCN(CC1)C1=C(F)C2=C(C=C1F)C(C(=CN2CCF)C(O[Si](C)(C)C)=O)=O