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N-(1-(Thiophen-2-ylsulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl)thiophene-2-sulfonamide
SpectraBase Compound ID GHH9MQRpGjx
InChI InChI=1S/C17H16N2O4S4/c20-26(21,16-5-2-10-24-16)18-14-8-7-13-4-1-9-19(15(13)12-14)27(22,23)17-6-3-11-25-17/h2-3,5-8,10-12,18H,1,4,9H2
InChIKey KOVIHBSLQLKCHS-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C17H16N2O4S4
Exact Mass 439.999292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JSLnnVqTWBR
Name N-(1-(Thiophen-2-ylsulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl)thiophene-2-sulfonamide
Appearance White solid
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Formula C17H16N2O4S4
InChI InChI=1S/C17H16N2O4S4/c20-26(21,16-5-2-10-24-16)18-14-8-7-13-4-1-9-19(15(13)12-14)27(22,23)17-6-3-11-25-17/h2-3,5-8,10-12,18H,1,4,9H2
InChIKey KOVIHBSLQLKCHS-UHFFFAOYSA-N
Instrument Name Shimadzu QP-5000
Ionization Type EI
Literature Reference DOI 10.1021/ml400487t
Molecular Weight 440.565 g/mol
Reported Formula C17H16N2O4S4
SMILES N(c1cc2c(CCCN2S(c2cccs2)(=O)=O)cc1)S(c1cccs1)(=O)=O
SPLASH splash10-00ov-2943100000-67b1506fbffa5d3aa20e
Source of Spectrum MCS-5-SM19-32
Wiley ID 1864156