SpectraBase Spectrum ID |
CELOECH0e9C |
Name |
N-[1-(4-Methoxyphenyl)-3-phenylprop-2-yn-1-yl]-S,S-methylphenyl sulfoximine |
Appearance |
Brown oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
375.129300092 u |
Formula |
C23H21NO2S |
InChI |
InChI=1S/C23H21NO2S/c1-26-21-16-14-20(15-17-21)23(18-13-19-9-5-3-6-10-19)24-27(2,25)22-11-7-4-8-12-22/h3-12,14-17,23H,1-2H3 |
InChIKey |
GKBUEWCTEAJPGW-UHFFFAOYSA-N |
Instrument Name |
Finnigan SSQ 7000 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201700953 |
Molecular Weight |
375.486 g/mol |
Quality |
58 |
Reported Formula |
C23H21NO2S |
SMILES |
C1(S(=NC(C#CC2=CC=CC=C2)C2=CC=C(C=C2)OC)(C)=O)=CC=CC=C1 |
SPLASH |
splash10-002r-1690000000-427a3f931544926d531c |
Sample Comments |
dr = 42:58 |
Source of Spectrum |
QE-23-SM7-4r (DOI: 10.1002/chem.201700953) |
Wiley ID |
1905763 |