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4-Bromo-N-(1-(ethylsulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl)-2-fluorobenzenesulfonamide
SpectraBase Compound ID CHF7dPvf9LZ
InChI InChI=1S/C17H18BrFN2O4S2/c1-2-26(22,23)21-9-3-4-12-5-7-14(11-16(12)21)20-27(24,25)17-8-6-13(18)10-15(17)19/h5-8,10-11,20H,2-4,9H2,1H3
InChIKey ATTBLHMQSMURRX-UHFFFAOYSA-N
Mol Weight 477.36 g/mol
Molecular Formula C17H18BrFN2O4S2
Exact Mass 475.987541 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IlXZhUZoUZZ
Name 4-Bromo-N-(1-(ethylsulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl)-2-fluorobenzenesulfonamide
Appearance Red solid
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Formula C17H18BrFN2O4S2
InChI InChI=1S/C17H18BrFN2O4S2/c1-2-26(22,23)21-9-3-4-12-5-7-14(11-16(12)21)20-27(24,25)17-8-6-13(18)10-15(17)19/h5-8,10-11,20H,2-4,9H2,1H3
InChIKey ATTBLHMQSMURRX-UHFFFAOYSA-N
Instrument Name Shimadzu QP-5000
Ionization Type EI
Literature Reference DOI 10.1021/ml400487t
Molecular Weight 477.363 g/mol
Reported Formula C17H18(79)BrFN2O4S2
SMILES N(c1ccc2CCCN(c2c1)S(CC)(=O)=O)S(=O)(=O)c1c(cc(cc1)Br)F
SPLASH splash10-0002-0900000000-da7b7f13b7171820aa5f
Source of Spectrum MCS-5-SM9-15
Wiley ID 1864140