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N-[[(2R,3R)-3-cyclohexyloxiran-2-yl]-keto-phenyl-persulfuranylidene]-4-methyl-benzenesulfonamide
SpectraBase Compound ID I2IVBL7MewJ
InChI InChI=1S/C21H25NO4S2/c1-16-12-14-19(15-13-16)28(24,25)22-27(23,18-10-6-3-7-11-18)21-20(26-21)17-8-4-2-5-9-17/h3,6-7,10-15,17,20-21H,2,4-5,8-9H2,1H3/t20-,21-,27-/m1/s1
InChIKey WMWOEZOGQZBGRX-LGVUCKNBSA-N
Mol Weight 419.55 g/mol
Molecular Formula C21H25NO4S2
Exact Mass 419.122501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KKr23XUGMUB
Name N-[[(2R,3R)-3-cyclohexyloxiran-2-yl]-keto-phenyl-persulfuranylidene]-4-methyl-benzenesulfonamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO4S2
InChI InChI=1S/C21H25NO4S2/c1-16-12-14-19(15-13-16)28(24,25)22-27(23,18-10-6-3-7-11-18)21-20(26-21)17-8-4-2-5-9-17/h3,6-7,10-15,17,20-21H,2,4-5,8-9H2,1H3/t20-,21-,27-/m1/s1
InChIKey WMWOEZOGQZBGRX-LGVUCKNBSA-N
Molecular Weight 419.554 g/mol
SMILES [C@@]1([S@](=NS(c2ccc(cc2)C)(=O)=O)(=O)c2ccccc2)(O[C@@]1(C1CCCCC1)[H])[H]
SPLASH splash10-004i-0090100000-1be08a9c66828f650d3c
Source of Spectrum KC-0-3361-6
Synonyms N-[[(2R,3R)-3-cyclohexyl-2-oxiranyl]-oxo-phenyl-$l^{6}-sulfanylidene]-4-methylbenzenesulfonamide N-[[(2R,3R)-3-cyclohexyloxiran-2-yl]-oxo-phenyl-$l^{6}-sulfanylidene]-4-methylbenzenesulfonamide N-[[(2R,3R)-3-cyclohexyloxiran-2-yl]-oxo-phenyl-$l^{6}-sulfanylidene]-4-methyl-benzenesulfonamide
Wiley ID 826725