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11-CYCLOPROPYL-6-FLUORO-2,8-DIOXO-1,2,3,4,8,11-HEXAHYDRO-[1,4]-THIAZEPINO-[2,3-H]-QUINOLINE-9-CARBOXYLIC-ACID
SpectraBase Compound ID CpyOAmb7qdy
InChI InChI=1S/C16H13FN2O4S/c17-10-5-8-13(12-15(10)24-4-3-11(20)18-12)19(7-1-2-7)6-9(14(8)21)16(22)23/h5-7H,1-4H2,(H,18,20)(H,22,23)
InChIKey DHUCLGAWJOCLDG-UHFFFAOYSA-N
Mol Weight 348.35 g/mol
Molecular Formula C16H13FN2O4S
Exact Mass 348.058006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6E02eQGeiEU
Name 11-CYCLOPROPYL-6-FLUORO-2,8-DIOXO-1,2,3,4,8,11-HEXAHYDRO-[1,4]-THIAZEPINO-[2,3-H]-QUINOLINE-9-CARBOXYLIC-ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13FN2O4S
InChI InChI=1S/C16H13FN2O4S/c17-10-5-8-13(12-15(10)24-4-3-11(20)18-12)19(7-1-2-7)6-9(14(8)21)16(22)23/h5-7H,1-4H2,(H,18,20)(H,22,23)
InChIKey DHUCLGAWJOCLDG-UHFFFAOYSA-N
Literature Reference Author M.H.AL-HUNITI,M.M.EL-ABADELAH,J.A.ZAHRA,S.S.SABRI,A.INGENDOH
Literature Reference Citation MOLECULES,12,1558(2007)
Literature Reference DOI 10.3390/12081558
Molecular Weight 348.349 g/mol
Sample ID 57462
Solvent DMSO-D6