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N-((2, 3-Diphenylcycloallyl)methyl)-4-methyl-N-(prop-2-ynyl)benzenesulfonamide
SpectraBase Compound ID T8k6nPxU1W
InChI InChI=1S/C26H23NO2S/c1-3-18-27(30(28,29)23-16-14-20(2)15-17-23)19-24-25(21-10-6-4-7-11-21)26(24)22-12-8-5-9-13-22/h1,4-17,24H,18-19H2,2H3
InChIKey QUGMFWXANVWHRM-UHFFFAOYSA-N
Mol Weight 413.54 g/mol
Molecular Formula C26H23NO2S
Exact Mass 413.14495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KPw0T7rHj7D
Name N-((2, 3-Diphenylcycloallyl)methyl)-4-methyl-N-(prop-2-ynyl)benzenesulfonamide
Alternate Name(s) N-((2,3-diphenylcycloprop-2-en-1-yl)methyl)-4-methyl-N-(prop-2-yn-1-yl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H23NO2S
InChI InChI=1S/C26H23NO2S/c1-3-18-27(30(28,29)23-16-14-20(2)15-17-23)19-24-25(21-10-6-4-7-11-21)26(24)22-12-8-5-9-13-22/h1,4-17,24H,18-19H2,2H3
InChIKey QUGMFWXANVWHRM-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol101091r
Molecular Weight 413.535 g/mol
SMILES C1(c2ccccc2)=C(C1CN(S(c1ccc(cc1)C)(=O)=O)CC#C)c1ccccc1
SPLASH splash10-0006-9300000000-b66b6f611557cf782ed3
Source of Spectrum A1-12-3082/SMS5-3a
Wiley ID 1752355