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3-Methyl-N-(1-(propylsulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl)benzenesulfonamide
SpectraBase Compound ID EL3Uc52uVTZ
InChI InChI=1S/C19H24N2O4S2/c1-3-12-26(22,23)21-11-5-7-16-9-10-17(14-19(16)21)20-27(24,25)18-8-4-6-15(2)13-18/h4,6,8-10,13-14,20H,3,5,7,11-12H2,1-2H3
InChIKey SJVTZTTUHBUAJZ-UHFFFAOYSA-N
Mol Weight 408.53 g/mol
Molecular Formula C19H24N2O4S2
Exact Mass 408.11775 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9MaOzNTouwU
Name 3-Methyl-N-(1-(propylsulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl)benzenesulfonamide
Appearance Yellow oil
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Formula C19H24N2O4S2
InChI InChI=1S/C19H24N2O4S2/c1-3-12-26(22,23)21-11-5-7-16-9-10-17(14-19(16)21)20-27(24,25)18-8-4-6-15(2)13-18/h4,6,8-10,13-14,20H,3,5,7,11-12H2,1-2H3
InChIKey SJVTZTTUHBUAJZ-UHFFFAOYSA-N
Instrument Name Shimadzu QP-5000
Ionization Type EI
Literature Reference DOI 10.1021/ml400487t
Molecular Weight 408.531 g/mol
Reported Formula C19H24N2O4S2
SMILES N(c1cc2c(CCCN2S(CCC)(=O)=O)cc1)S(c1cccc(c1)C)(=O)=O
SPLASH splash10-00ke-5902200000-d689f8630900ff0567cc
Source of Spectrum MCS-5-SM17-28
Wiley ID 1864151