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N-[3-(2-aminophenyl)prop-2-ynyl]-N-but-2-ynyl-4-methyl-benzenesulfonamide
SpectraBase Compound ID 7w9tVQ8qXqH
InChI InChI=1S/C20H20N2O2S/c1-3-4-15-22(16-7-9-18-8-5-6-10-20(18)21)25(23,24)19-13-11-17(2)12-14-19/h5-6,8,10-14H,15-16,21H2,1-2H3
InChIKey BWDSCTCLZZDJDQ-UHFFFAOYSA-N
Mol Weight 352.45 g/mol
Molecular Formula C20H20N2O2S
Exact Mass 352.124549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4sgNg7OA367
Name N-[3-(2-aminophenyl)prop-2-ynyl]-N-but-2-ynyl-4-methyl-benzenesulfonamide
Appearance Light yellow oil
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Formula C20H20N2O2S
InChI InChI=1S/C20H20N2O2S/c1-3-4-15-22(16-7-9-18-8-5-6-10-20(18)21)25(23,24)19-13-11-17(2)12-14-19/h5-6,8,10-14H,15-16,21H2,1-2H3
InChIKey BWDSCTCLZZDJDQ-UHFFFAOYSA-N
Instrument Name HP-5989
Ionization Type EI
Literature Reference DOI 10.1002/chem.201602545
Molecular Weight 352.452 g/mol
Quality 21
Reported Formula C20H20N2O2S
SMILES NC=1C=CC=CC1C#CCN(S(C1=CC=C(C=C1)C)(=O)=O)CC#CC
SPLASH splash10-0005-4900000000-f76caac3bbf6155d5de4
Source of Spectrum QE-22-SM104-15 (DOI: 10.1002/chem.201602545)
Wiley ID 1905128