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N-(2-(1H-indole-1-carbonyl)phenyl)-4-nitrobenzenesulfonamide
SpectraBase Compound ID 8RmVXY5iZH6
InChI InChI=1S/C21H15N3O5S/c25-21(23-14-13-15-5-1-4-8-20(15)23)18-6-2-3-7-19(18)22-30(28,29)17-11-9-16(10-12-17)24(26)27/h1-14,22H
InChIKey FILIBTBQCHYFQR-UHFFFAOYSA-N
Mol Weight 421.43 g/mol
Molecular Formula C21H15N3O5S
Exact Mass 421.073242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B7vz4tudYmW
Name N-(2-(1H-indole-1-carbonyl)phenyl)-4-nitrobenzenesulfonamide
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15N3O5S
InChI InChI=1S/C21H15N3O5S/c25-21(23-14-13-15-5-1-4-8-20(15)23)18-6-2-3-7-19(18)22-30(28,29)17-11-9-16(10-12-17)24(26)27/h1-14,22H
InChIKey FILIBTBQCHYFQR-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI positive ion
Literature Reference DOI 10.1002/adsc.202100290
Molecular Weight 421.427 g/mol
SMILES N(c1c(C([n]2c3c(cccc3)cc2)=O)cccc1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
SPLASH splash10-01bi-6951200000-a2ad335d04470043736a
Source of Spectrum ASC-363-SM12-3l
Thin-Layer Chromatography Rf = 0.45 (n-pentane/ethyl acetate, 3:1)
Wiley ID 1851181