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7-{4-[(4-bromophenyl)sulfonyl]-1-piperazinyl}-1-ethyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
SpectraBase Compound ID GnGaJpRzTP3
InChI InChI=1S/C22H21BrFN3O5S/c1-2-25-13-17(22(29)30)21(28)16-11-18(24)20(12-19(16)25)26-7-9-27(10-8-26)33(31,32)15-5-3-14(23)4-6-15/h3-6,11-13H,2,7-10H2,1H3,(H,29,30)
InChIKey PZMDOSRYUHVUNU-UHFFFAOYSA-N
Mol Weight 538.39 g/mol
Molecular Formula C22H21BrFN3O5S
Exact Mass 537.036933 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 39mglBGCNMc
Name 7-{4-[(4-bromophenyl)sulfonyl]-1-piperazinyl}-1-ethyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H21BrFN3O5S/c1-2-25-13-17(22(29)30)21(28)16-11-18(24)20(12-19(16)25)26-7-9-27(10-8-26)33(31,32)15-5-3-14(23)4-6-15/h3-6,11-13H,2,7-10H2,1H3,(H,29,30)
InChIKey PZMDOSRYUHVUNU-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_7955
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 127920; Labnumber: ZUKR1-0228; VK_ID: VK-007959
Temperature 308 °C