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N-((2,3-Diphenylcycloallyl)methyl)-4-methyl-N-(4-phenylbut-3-yn-2-yl)benzenesulfonamide
SpectraBase Compound ID EMYWjiJyuIQ
InChI InChI=1S/C33H29NO2S/c1-25-18-22-30(23-19-25)37(35,36)34(26(2)20-21-27-12-6-3-7-13-27)24-31-32(28-14-8-4-9-15-28)33(31)29-16-10-5-11-17-29/h3-19,22-23,26,31H,24H2,1-2H3
InChIKey SATDGXQSYWZVOQ-UHFFFAOYSA-N
Mol Weight 503.7 g/mol
Molecular Formula C33H29NO2S
Exact Mass 503.1919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jlkMqTFWF6
Name N-((2,3-Diphenylcycloallyl)methyl)-4-methyl-N-(4-phenylbut-3-yn-2-yl)benzenesulfonamide
Alternate Name(s) N-((2,3-diphenylcycloprop-2-en-1-yl)methyl)-4-methyl-N-(4-phenylbut-3-yn-2-yl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H29NO2S
InChI InChI=1S/C33H29NO2S/c1-25-18-22-30(23-19-25)37(35,36)34(26(2)20-21-27-12-6-3-7-13-27)24-31-32(28-14-8-4-9-15-28)33(31)29-16-10-5-11-17-29/h3-19,22-23,26,31H,24H2,1-2H3
InChIKey SATDGXQSYWZVOQ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol101091r
Molecular Weight 503.660 g/mol
SMILES C1(c2ccccc2)=C(C1CN(C(C#Cc1ccccc1)C)S(=O)(=O)c1ccc(cc1)C)c1ccccc1
SPLASH splash10-0006-1901000000-f818f3c65d2fcc2aa4a4
Source of Spectrum A1-12-3082/SMS6-3d
Wiley ID 1752358