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1-Ethyl-6-fluoro-7-(4-isobutyryl-1-piperazinyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
SpectraBase Compound ID 8D4DvrkkoLj
InChI InChI=1S/C20H24FN3O4/c1-4-22-11-14(20(27)28)18(25)13-9-15(21)17(10-16(13)22)23-5-7-24(8-6-23)19(26)12(2)3/h9-12H,4-8H2,1-3H3,(H,27,28)
InChIKey VRPILGBTJVJDMF-UHFFFAOYSA-N
Mol Weight 389.43 g/mol
Molecular Formula C20H24FN3O4
Exact Mass 389.175084 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1KuxKWCCPBE
Name 1-Ethyl-6-fluoro-7-(4-isobutyryl-1-piperazinyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 389.175084424 u
Formula C20H24FN3O4
InChI InChI=1S/C20H24FN3O4/c1-4-22-11-14(20(27)28)18(25)13-9-15(21)17(10-16(13)22)23-5-7-24(8-6-23)19(26)12(2)3/h9-12H,4-8H2,1-3H3,(H,27,28)
InChIKey VRPILGBTJVJDMF-UHFFFAOYSA-N
Molecular Weight 389.427 g/mol
SMILES OC(C=1C(C2=CC(F)=C(C=C2N(C1)CC)N1CCN(CC1)C(=O)C(C)C)=O)=O