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N-(2-(1H-indole-1-carbonyl)phenyl)-4-iodobenzenesulfonamide
SpectraBase Compound ID Ln4PfcgrbqP
InChI InChI=1S/C21H15IN2O3S/c22-16-9-11-17(12-10-16)28(26,27)23-19-7-3-2-6-18(19)21(25)24-14-13-15-5-1-4-8-20(15)24/h1-14,23H
InChIKey IALLGYQKZLXEBF-UHFFFAOYSA-N
Mol Weight 502.33 g/mol
Molecular Formula C21H15IN2O3S
Exact Mass 501.984809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L471UpjzfXh
Name N-(2-(1H-indole-1-carbonyl)phenyl)-4-iodobenzenesulfonamide
Appearance Yellow solid
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Formula C21H15IN2O3S
InChI InChI=1S/C21H15IN2O3S/c22-16-9-11-17(12-10-16)28(26,27)23-19-7-3-2-6-18(19)21(25)24-14-13-15-5-1-4-8-20(15)24/h1-14,23H
InChIKey IALLGYQKZLXEBF-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI positive ion
Literature Reference DOI 10.1002/adsc.202100290
Molecular Weight 502.326 g/mol
Reported Formula C21H15N2O3IS
SMILES N(c1c(C([n]2c3c(cccc3)cc2)=O)cccc1)S(c1ccc(cc1)I)(=O)=O
SPLASH splash10-0fri-2893050000-bcb2cf84a5d1775fac19
Source of Spectrum ASC-363-SM11-3j
Thin-Layer Chromatography Rf = 0.25 (n-pentane/ethyl acetate, 10:1)
Wiley ID 1851179