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5,8-DIFLUORO-4-[(alpha,alpha,alpha-TRIFLUORO-m-TOLYL)THIO]-3-QUINOLINECARBOXYLIC ACID, ETHYL ESTER
SpectraBase Compound ID IPg3CdTdt2z
InChI InChI=1S/C19H12F5NO2S/c1-2-27-18(26)12-9-25-16-14(21)7-6-13(20)15(16)17(12)28-11-5-3-4-10(8-11)19(22,23)24/h3-9H,2H2,1H3
InChIKey CFNDXJQYXJCRJZ-UHFFFAOYSA-N
Mol Weight 413.36 g/mol
Molecular Formula C19H12F5NO2S
Exact Mass 413.050891 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8FuHstW9xUp
Name 5,8-DIFLUORO-4-[(alpha,alpha,alpha-TRIFLUORO-m-TOLYL)THIO]-3-QUINOLINECARBOXYLIC ACID, ETHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H12F5NO2S
InChI InChI=1S/C19H12F5NO2S/c1-2-27-18(26)12-9-25-16-14(21)7-6-13(20)15(16)17(12)28-11-5-3-4-10(8-11)19(22,23)24/h3-9H,2H2,1H3
InChIKey CFNDXJQYXJCRJZ-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Molecular Weight 413.37
Solvent CDCl3; Reference=TMS; Temperature 297K