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

View entire compound with spectra: 2 MS (GC)

7-[4-(1-Acetamido-1-ethoxycarbonyl-2,2,2-trifluoroethyl)-1-piperazinyl]-1-cyclopropyl-6-fluoro-4(1H)-oxoquinoline-3-carboxylic acid
SpectraBase Compound ID 69t2cHTD4CH
InChI InChI=1S/C24H26F4N4O6/c1-3-38-22(37)23(24(26,27)28,29-13(2)33)31-8-6-30(7-9-31)19-11-18-15(10-17(19)25)20(34)16(21(35)36)12-32(18)14-4-5-14/h10-12,14H,3-9H2,1-2H3,(H,29,33)(H,35,36)
InChIKey UENMOZQRYAOARQ-UHFFFAOYSA-N
Mol Weight 542.49 g/mol
Molecular Formula C24H26F4N4O6
Exact Mass 542.178847 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6po8yb6F7LE
Name 7-[4-(1-ACETAMIDO-1-ETHOXYCARBONYL-2,2,2-TRIFLUOROETHYL)-1-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C24H26F4N4O6
InChI InChI=1S/C24H26F4N4O6/c1-3-38-22(37)23(24(26,27)28,29-13(2)33)31-8-6-30(7-9-31)19-11-18-15(10-17(19)25)20(34)16(21(35)36)12-32(18)14-4-5-14/h10-12,14H,3-9H2,1-2H3,(H,29,33)(H,35,36)
InChIKey UENMOZQRYAOARQ-UHFFFAOYSA-N
Molecular Weight 542.1782
SMILES N(C(C)=O)C(N1CCN(c2c(cc3C(C(C(O)=O)=CN(c3c2)C2CC2)=O)F)CC1)(C(F)(F)F)C(OCC)=O
SPLASH splash10-0006-9350000000-4160e1dfc8dd6651aa8e
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany