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4-Phenyl-4-N-(p-toluenesulfonyl)amino-1-butyne
SpectraBase Compound ID DjI1gw31DCw
InChI InChI=1S/C17H17NO2S/c1-3-7-17(15-8-5-4-6-9-15)18-21(19,20)16-12-10-14(2)11-13-16/h1,4-6,8-13,17-18H,7H2,2H3
InChIKey PDCBHFABOMQTSJ-UHFFFAOYSA-N
Mol Weight 299.39 g/mol
Molecular Formula C17H17NO2S
Exact Mass 299.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7WgimwxzsGR
Name 4-Phenyl-4-N-(p-toluenesulfonyl)amino-1-butyne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO2S
InChI InChI=1S/C17H17NO2S/c1-3-7-17(15-8-5-4-6-9-15)18-21(19,20)16-12-10-14(2)11-13-16/h1,4-6,8-13,17-18H,7H2,2H3
InChIKey PDCBHFABOMQTSJ-UHFFFAOYSA-N
Molecular Weight 299.388 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(c1ccccc1)CC#C
SPLASH splash10-01ox-9240000000-b040da0f420271fdad87
Source of Spectrum KC-61-9591-4
Synonyms 4-Methyl-N-(1-phenyl-3-butynyl)benzenesulfonamide
Wiley ID 1630731