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N-[2,6-dimethyl-4-oxo-3-(toluene-4-sulfonyl)-cyclohexa-2,5-dienylidene]-4-methyl-benzenesulfonamide
SpectraBase Compound ID CPzw6nH7TSB
InChI InChI=1S/C22H21NO5S2/c1-14-5-9-18(10-6-14)29(25,26)22-17(4)21(16(3)13-20(22)24)23-30(27,28)19-11-7-15(2)8-12-19/h5-13H,1-4H3/b23-21+
InChIKey ASXAEDFZRGLOAV-XTQSDGFTSA-N
Mol Weight 443.53 g/mol
Molecular Formula C22H21NO5S2
Exact Mass 443.086115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CYwFArsu9BF
Name N-[2,6-dimethyl-4-oxo-3-(toluene-4-sulfonyl)-cyclohexa-2,5-dienylidene]-4-methyl-benzenesulfonamide
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Formula C22H21NO5S2
InChI InChI=1S/C22H21NO5S2/c1-14-5-9-18(10-6-14)29(25,26)22-17(4)21(16(3)13-20(22)24)23-30(27,28)19-11-7-15(2)8-12-19/h5-13H,1-4H3/b23-21+
InChIKey ASXAEDFZRGLOAV-XTQSDGFTSA-N
Molecular Weight 443.532 g/mol
SMILES C1(S(c2ccc(cc2)C)(=O)=O)=C(\C(=N\S(c2ccc(cc2)C)(=O)=O)C(=CC1=O)C)C
SPLASH splash10-0006-9430000000-52f8882ab58e18c3bfdb
Synonyms N-{(1E)-2,6-dimethyl-3-[(4-methylphenyl)sulfonyl]-4-oxo-2,5-cyclohexadien-1-ylidene}-4-methylbenzenesulfonamide N-{2,6-dimethyl-3-[(4-methylphenyl)sulfonyl]-4-oxo-2,5-cyclohexadien-1-ylidene}-4-methylbenzenesulfonamide
Wiley ID 1439178