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N,N'-1,3-Butadiyn-1,4-diyl-N,N'-dibenzyl ditosylamide
SpectraBase Compound ID co1UUkcxeZ
InChI InChI=1S/C32H28N2O4S2/c1-27-15-19-31(20-16-27)39(35,36)33(25-29-11-5-3-6-12-29)23-9-10-24-34(26-30-13-7-4-8-14-30)40(37,38)32-21-17-28(2)18-22-32/h3-8,11-22H,25-26H2,1-2H3
InChIKey GFFUGXQASVKHIB-UHFFFAOYSA-N
Mol Weight 568.7 g/mol
Molecular Formula C32H28N2O4S2
Exact Mass 568.14905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UGAgpP8MY7
Name N,N'-1,3-Butadiyn-1,4-diyl-N,N'-dibenzyl ditosylamide
Alternate Name(s) N-benzyl-N-(4-{benzyl[(4-methylphenyl)sulfonyl]amino}-1,3-butadiynyl)-4-methylbenzenesulfonamide N-benzyl-N-[4-[benzyl-(4-methylphenyl)sulfonylamino]buta-1,3-diynyl]-4-methylbenzenesulfonamide N-benzyl-N-[4-[benzyl(p-tolylsulfonyl)amino]buta-1,3-diynyl]-4-methyl-benzenesulfonamide 4-Methyl-N-[4-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]buta-1,3-diynyl]-N-(phenylmethyl)benzenesulfonamide
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Formula C32H28N2O4S2
InChI InChI=1S/C32H28N2O4S2/c1-27-15-19-31(20-16-27)39(35,36)33(25-29-11-5-3-6-12-29)23-9-10-24-34(26-30-13-7-4-8-14-30)40(37,38)32-21-17-28(2)18-22-32/h3-8,11-22H,25-26H2,1-2H3
InChIKey GFFUGXQASVKHIB-UHFFFAOYSA-N
Molecular Weight 568.706 g/mol
SMILES C(N(S(c1ccc(cc1)C)(=O)=O)Cc1ccccc1)#CC#CN(S(c1ccc(cc1)C)(=O)=O)Cc1ccccc1
SPLASH splash10-03dr-0500930000-767660f1315a3062820f
Source of Spectrum F-62-3850-6
Wiley ID 1632982