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7-[4-(1-Butyramido-1-ethoxycarbonyl-2,2,2-trifluoroethyl)-1-piperazinyl]-1-cyclopropyl-6-fluoro-4(1H)-oxoquinoline-3-carboxylic acid

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7-[4-(1-Butyramido-1-ethoxycarbonyl-2,2,2-trifluoroethyl)-1-piperazinyl]-1-cyclopropyl-6-fluoro-4(1H)-oxoquinoline-3-carboxylic acid
SpectraBase Compound ID 1SDUw3JGaP8
InChI InChI=1S/C26H30F4N4O6/c1-3-5-21(35)31-25(26(28,29)30,24(39)40-4-2)33-10-8-32(9-11-33)20-13-19-16(12-18(20)27)22(36)17(23(37)38)14-34(19)15-6-7-15/h12-15H,3-11H2,1-2H3,(H,31,35)(H,37,38)
InChIKey KWCZPIZIAWHUOB-UHFFFAOYSA-N
Mol Weight 570.54 g/mol
Molecular Formula C26H30F4N4O6
Exact Mass 570.210147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZFS8pBd2ul
Name 7-[4-(1-BUTYRAMIDO-1-ETHOXYCARBONYL-2,2,2-TRIFLUOROETHYL)-1-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C26H30F4N4O6
InChI InChI=1S/C26H30F4N4O6/c1-3-5-21(35)31-25(26(28,29)30,24(39)40-4-2)33-10-8-32(9-11-33)20-13-19-16(12-18(20)27)22(36)17(23(37)38)14-34(19)15-6-7-15/h12-15H,3-11H2,1-2H3,(H,31,35)(H,37,38)
InChIKey KWCZPIZIAWHUOB-UHFFFAOYSA-N
Molecular Weight 570.2094
SMILES N(C(CCC)=O)C(N1CCN(c2cc3N(C=C(C(O)=O)C(c3cc2F)=O)C2CC2)CC1)(C(F)(F)F)C(OCC)=O
SPLASH splash10-006x-9010000000-a9adf8fe0e7ea9b3e44c
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany