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N-[keto-[(E)-3-methyl-1-(phenylthio)but-1-enyl]-phenyl-persulfuranylidene]-4-methyl-benzenesulfonamide
SpectraBase Compound ID 3jDqwN9PjTF
InChI InChI=1S/C24H25NO3S3/c1-19(2)18-24(29-21-10-6-4-7-11-21)30(26,22-12-8-5-9-13-22)25-31(27,28)23-16-14-20(3)15-17-23/h4-19H,1-3H3/b24-18+
InChIKey QLGPCWUDXGSPEV-HKOYGPOVSA-N
Mol Weight 471.65 g/mol
Molecular Formula C24H25NO3S3
Exact Mass 471.099657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 22JJ3wUauEI
Name N-[keto-[(E)-3-methyl-1-(phenylthio)but-1-enyl]-phenyl-persulfuranylidene]-4-methyl-benzenesulfonamide
Alternate Name(s) 4-methyl-N-[[(E)-3-methyl-1-(phenylthio)but-1-enyl]-oxo-phenyl-$l^{6}-sulfanylidene]benzenesulfonamide 4-methyl-N-[[(E)-3-methyl-1-phenylsulfanylbut-1-enyl]-oxo-phenyl-$l^{6}-sulfanylidene]benzenesulfonamide 4-methyl-N-[[(E)-3-methyl-1-phenylsulfanyl-but-1-enyl]-oxo-phenyl-$l^{6}-sulfanylidene]benzenesulfonamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H25NO3S3
InChI InChI=1S/C24H25NO3S3/c1-19(2)18-24(29-21-10-6-4-7-11-21)30(26,22-12-8-5-9-13-22)25-31(27,28)23-16-14-20(3)15-17-23/h4-19H,1-3H3/b24-18+
InChIKey QLGPCWUDXGSPEV-HKOYGPOVSA-N
Molecular Weight 471.648 g/mol
SMILES c1(S(N=S(=O)(\C(=C\C(C)C)Sc2ccccc2)c2ccccc2)(=O)=O)ccc(cc1)C
SPLASH splash10-00di-0009000000-dc2bd427fc6c696a6492
Source of Spectrum KC-1993-581-9
Wiley ID 779059