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N-(4-Nitrobenzenesulphonyl)-4-methylbenzene-trifluoromethyl sulfoximine
SpectraBase Compound ID HQ4djmo1WDk
InChI InChI=1S/C14H11F3N2O5S2/c1-10-2-6-12(7-3-10)25(22,14(15,16)17)18-26(23,24)13-8-4-11(5-9-13)19(20)21/h2-9H,1H3
InChIKey XCROINREEUIXLS-UHFFFAOYSA-N
Mol Weight 408.37 g/mol
Molecular Formula C14H11F3N2O5S2
Exact Mass 408.006148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXmAS31PNXw
Name N-(4-Nitrobenzenesulphonyl)-4-methylbenzene-trifluoromethyl sulfoximine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11F3N2O5S2
InChI InChI=1S/C14H11F3N2O5S2/c1-10-2-6-12(7-3-10)25(22,14(15,16)17)18-26(23,24)13-8-4-11(5-9-13)19(20)21/h2-9H,1H3
InChIKey XCROINREEUIXLS-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol103030w
Molecular Weight 408.366 g/mol
SMILES c1(S(=NS(c2ccc(cc2)[N+](=O)[O-])(=O)=O)(=O)C(F)(F)F)ccc(cc1)C
SPLASH splash10-052u-7609000000-28ab1e6aa72eb311ca21
Source of Spectrum A1-13-768/SMS21-11b
Wiley ID 1749910