| SpectraBase Spectrum ID |
5YCwf7qh7EH |
| Name |
4-((4-fluorophenyl)sulfonyl)benzonitrile |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.025977837 u |
| Formula |
C13H8FNO2S |
| InChI |
InChI=1S/C13H8FNO2S/c14-11-3-7-13(8-4-11)18(16,17)12-5-1-10(9-15)2-6-12/h1-8H |
| InChIKey |
BOHOLRBQJBATTM-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201711104 |
| Molecular Weight |
261.270 g/mol |
| Quality |
146 |
| Reported Formula |
C13H8O2NSF |
| SMILES |
C1=CC(=CC=C1C#N)S(C1=CC=C(C=C1)F)(=O)=O |
| SPLASH |
splash10-03dl-1950000000-76a1125a781e6b73c865 |
| Source of Spectrum |
ACI-57-SM14-6f (DOI: 10.1002/anie.201711104) |
| Wiley ID |
1891177 |
