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3,5-Dimethyl-N-(1-(propylsulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl)benzenesulfonamide
SpectraBase Compound ID ALM86zGSx8r
InChI InChI=1S/C20H26N2O4S2/c1-4-10-27(23,24)22-9-5-6-17-7-8-18(14-20(17)22)21-28(25,26)19-12-15(2)11-16(3)13-19/h7-8,11-14,21H,4-6,9-10H2,1-3H3
InChIKey DCAICBRLPKTZNX-UHFFFAOYSA-N
Mol Weight 422.56 g/mol
Molecular Formula C20H26N2O4S2
Exact Mass 422.1334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 798XUBPrqxV
Name 3,5-Dimethyl-N-(1-(propylsulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl)benzenesulfonamide
Appearance Orange oil
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Formula C20H26N2O4S2
InChI InChI=1S/C20H26N2O4S2/c1-4-10-27(23,24)22-9-5-6-17-7-8-18(14-20(17)22)21-28(25,26)19-12-15(2)11-16(3)13-19/h7-8,11-14,21H,4-6,9-10H2,1-3H3
InChIKey DCAICBRLPKTZNX-UHFFFAOYSA-N
Instrument Name Shimadzu QP-5000
Ionization Type EI
Literature Reference DOI 10.1021/ml400487t
Molecular Weight 422.558 g/mol
Reported Formula C20H26N2O4S2
SMILES N(c1cc2c(CCCN2S(CCC)(=O)=O)cc1)S(c1cc(cc(c1)C)C)(=O)=O
SPLASH splash10-00kb-0922200000-7757596655a6afd422fa
Source of Spectrum MCS-5-SM18-30
Wiley ID 1864154