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N-(2-(5-chloro-1H-indole-1-carbonyl)phenyl)-4-methylbenzenesulfonamide
SpectraBase Compound ID 9FWUml7nhPU
InChI InChI=1S/C22H17ClN2O3S/c1-15-6-9-18(10-7-15)29(27,28)24-20-5-3-2-4-19(20)22(26)25-13-12-16-14-17(23)8-11-21(16)25/h2-14,24H,1H3
InChIKey NASDKKLCBVEMKR-UHFFFAOYSA-N
Mol Weight 424.9 g/mol
Molecular Formula C22H17ClN2O3S
Exact Mass 424.064841 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ECJRCMx4he8
Name N-(2-(5-chloro-1H-indole-1-carbonyl)phenyl)-4-methylbenzenesulfonamide
Appearance Yellow solid
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Formula C22H17ClN2O3S
InChI InChI=1S/C22H17ClN2O3S/c1-15-6-9-18(10-7-15)29(27,28)24-20-5-3-2-4-19(20)22(26)25-13-12-16-14-17(23)8-11-21(16)25/h2-14,24H,1H3
InChIKey NASDKKLCBVEMKR-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI positive ion
Literature Reference DOI 10.1002/adsc.202100290
Molecular Weight 424.902 g/mol
Reported Formula C22H17ClN2O3S
SMILES N(c1c(C([n]2c3c(cc(Cl)cc3)cc2)=O)cccc1)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-00xr-1290000000-e8f11735120b28de30b2
Source of Spectrum ASC-363-SM23-5e
Thin-Layer Chromatography Rf = 0.28 (n-pentane/ethyl acetate, 5:1)
Wiley ID 1851204