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N-(2-(2-bromophenyl)-2-methylpropyl)-N,4-dimethylbenzenesulfonamide
SpectraBase Compound ID J7LEaNYJjxl
InChI InChI=1S/C18H22BrNO2S/c1-14-9-11-15(12-10-14)23(21,22)20(4)13-18(2,3)16-7-5-6-8-17(16)19/h5-12H,13H2,1-4H3
InChIKey KEWRUYZTSLNFDP-UHFFFAOYSA-N
Mol Weight 396.34 g/mol
Molecular Formula C18H22BrNO2S
Exact Mass 395.055463 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AvT1pLdJi4S
Name N-(2-(2-bromophenyl)-2-methylpropyl)-N,4-dimethylbenzenesulfonamide
Appearance White solid
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Formula C18H22BrNO2S
InChI InChI=1S/C18H22BrNO2S/c1-14-9-11-15(12-10-14)23(21,22)20(4)13-18(2,3)16-7-5-6-8-17(16)19/h5-12H,13H2,1-4H3
InChIKey KEWRUYZTSLNFDP-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C VL/5975 GC
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.1c00617
Molecular Weight 396.343 g/mol
SMILES c1cc(C(C)(C)CN(S(c2ccc(C)cc2)(=O)=O)C)c(Br)cc1
SPLASH splash10-052b-2900000000-936def931b757128a6f6
Source of Spectrum A1-23-SM16-1u
Thin-Layer Chromatography Rf = 0.35 (silica, petroleum ether/ethyl acetate, 10:1)
Wiley ID 1868166