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1-Decyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid

View entire compound with spectra: 2 NMR

1-Decyl-6,7-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
SpectraBase Compound ID B4lAjqifXdn
InChI InChI=1S/C20H25F2NO3/c1-2-3-4-5-6-7-8-9-10-23-13-15(20(25)26)19(24)14-11-16(21)17(22)12-18(14)23/h11-13H,2-10H2,1H3,(H,25,26)
InChIKey SOYHSEDTYGHQGB-UHFFFAOYSA-N
Mol Weight 365.42 g/mol
Molecular Formula C20H25F2NO3
Exact Mass 365.18025 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3MaD9oXfksg
Name 1-Decyl-6,7-difluoro-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 365.180249992 u
Formula C20H25F2NO3
InChI InChI=1S/C20H25F2NO3/c1-2-3-4-5-6-7-8-9-10-23-13-15(20(25)26)19(24)14-11-16(21)17(22)12-18(14)23/h11-13H,2-10H2,1H3,(H,25,26)
InChIKey SOYHSEDTYGHQGB-UHFFFAOYSA-N
Molecular Weight 365.421 g/mol
SMILES OC(C=1C(C=2C=C(F)C(=CC2N(C1)CCCCCCCCCC)F)=O)=O