| SpectraBase Spectrum ID |
2Q8JUcNsQnb |
| Name |
4-(2-Cyano-2-(phenylsulfonyl)ethyl)phenyl acetate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H15NO4S |
| InChI |
InChI=1S/C17H15NO4S/c1-13(19)22-15-9-7-14(8-10-15)11-17(12-18)23(20,21)16-5-3-2-4-6-16/h2-10,17H,11H2,1H3 |
| InChIKey |
KZVASTANGUXZQI-UHFFFAOYSA-N |
| Instrument Name |
Thermo Finnigan TSQ 700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202005400 |
| Molecular Weight |
329.370 g/mol |
| Quality |
87 |
| Reported Formula |
C17H15NO4S |
| SMILES |
C1=CC=C(C=C1)S(C(CC1=CC=C(C=C1)OC(C)=O)C#N)(=O)=O |
| SPLASH |
splash10-0002-0920000000-4794bef35b868e385ca2 |
| Source of Spectrum |
QE-27-SM5-1f (DOI: 10.1002/chem.202005400) |
| Thin-Layer Chromatography |
0.4 (pentane/CH2Cl2, 1:10) |
| Wiley ID |
1902073 |
