| SpectraBase Spectrum ID |
gjwkIxDWAY |
| Name |
N-[1-(Benzo[d][1,3]dioxol-5-yl)-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 |
389.108564647 u |
| Formula |
C23H19NO3S |
| InChI |
InChI=1S/C23H19NO3S/c1-28(25,20-10-6-3-7-11-20)24-21(14-12-18-8-4-2-5-9-18)19-13-15-22-23(16-19)27-17-26-22/h2-11,13,15-16,21H,17H2,1H3 |
| InChIKey |
AIYLBAPACDOCOG-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201700953 |
| Molecular Weight |
389.469 g/mol |
| Quality |
59 |
| Reported Formula |
C23H19NO3S |
| SMILES |
C1(S(=NC(C#CC2=CC=CC=C2)C2=CC3=C(C=C2)OCO3)(C)=O)=CC=CC=C1 |
| SPLASH |
splash10-004i-9710000000-59a21ced3a2e925d3c92 |
| Sample Comments |
dr = 58:42 |
| Source of Spectrum |
QE-23-SM7-4s (DOI: 10.1002/chem.201700953) |
| Wiley ID |
1905764 |
![N-[1-(Benzo[d][1,3]dioxol-5-yl)-3-phenylprop-2-yn-1-yl]-S,S-methylphenyl sulfoximine](/api/spectrum/gjwkIxDWAY/structure.png?h=300&w=458 "N-[1-(Benzo[d][1,3]dioxol-5-yl)-3-phenylprop-2-yn-1-yl]-S,S-methylphenyl sulfoximine")
