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1-Ethyl-6-fluoro-4-oxo-7-[4-(tetrahydro-2-furanylcarbonyl)-1-piperazinyl]-1,4-dihydro-3-quinolinecarboxylic acid

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1-Ethyl-6-fluoro-4-oxo-7-[4-(tetrahydro-2-furanylcarbonyl)-1-piperazinyl]-1,4-dihydro-3-quinolinecarboxylic acid
SpectraBase Compound ID IJkXEuQXKaZ
InChI InChI=1S/C21H24FN3O5/c1-2-23-12-14(21(28)29)19(26)13-10-15(22)17(11-16(13)23)24-5-7-25(8-6-24)20(27)18-4-3-9-30-18/h10-12,18H,2-9H2,1H3,(H,28,29)
InChIKey QGQJASCJFHKNMO-UHFFFAOYSA-N
Mol Weight 417.44 g/mol
Molecular Formula C21H24FN3O5
Exact Mass 417.169999 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J8WH9pA8bj4
Name 1-Ethyl-6-fluoro-4-oxo-7-[4-(tetrahydro-2-furanylcarbonyl)-1-piperazinyl]-1,4-dihydro-3-quinolinecarboxylic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 417.169999043 u
Formula C21H24FN3O5
InChI InChI=1S/C21H24FN3O5/c1-2-23-12-14(21(28)29)19(26)13-10-15(22)17(11-16(13)23)24-5-7-25(8-6-24)20(27)18-4-3-9-30-18/h10-12,18H,2-9H2,1H3,(H,28,29)
InChIKey QGQJASCJFHKNMO-UHFFFAOYSA-N
Molecular Weight 417.437 g/mol
SMILES OC(C=1C(C2=CC(F)=C(C=C2N(C1)CC)N1CCN(C(C2OCCC2)=O)CC1)=O)=O