| SpectraBase Spectrum ID |
8RKWfximpcX |
| Name |
N-[(1-(4-Methoxyphenyl)-3-(4-trifluoromethylphenyl))prop-2-yn-1-yl]-S,S-methylphenylsulfoximine |
| Appearance |
Colorless viscous oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
443.116684549 u |
| Formula |
C24H20F3NO2S |
| InChI |
InChI=1S/C24H20F3NO2S/c1-30-21-15-11-19(12-16-21)23(28-31(2,29)22-6-4-3-5-7-22)17-10-18-8-13-20(14-9-18)24(25,26)27/h3-9,11-16,23H,1-2H3 |
| InChIKey |
ABBYJSSHOXYLSG-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201801660 |
| Molecular Weight |
443.484 g/mol |
| Quality |
77 |
| Reported Formula |
C24H20F3NO2S |
| SMILES |
C1(C(C#CC=2C=CC(=CC2)C(F)(F)F)N=S(C2=CC=CC=C2)(C)=O)=CC=C(OC)C=C1 |
| SPLASH |
splash10-0udi-0229000000-7665e474a641004f5d74 |
| Sample Comments |
dr = 1:1 |
| Source of Spectrum |
ACI-57-SM12-5b (DOI: 10.1002/anie.201801660) |
| Wiley ID |
1890907 |
![N-[(1-(4-Methoxyphenyl)-3-(4-trifluoromethylphenyl))prop-2-yn-1-yl]-S,S-methylphenylsulfoximine](/api/spectrum/8RKWfximpcX/structure.png?h=300&w=458 "N-[(1-(4-Methoxyphenyl)-3-(4-trifluoromethylphenyl))prop-2-yn-1-yl]-S,S-methylphenylsulfoximine")
