| SpectraBase Spectrum ID |
9PsOZ8j1fKe |
| Name |
1-nitro-4-[(trifluoromethyl)thio]benzene |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
222.991484034 u |
| Formula |
C7H4F3NO2S |
| InChI |
InChI=1S/C7H4F3NO2S/c8-7(9,10)14-6-3-1-5(2-4-6)11(12)13/h1-4H |
| InChIKey |
ILLBHPYCTYQBQI-UHFFFAOYSA-N |
| Instrument Name |
Varian Saturn 2100 T |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201503524 |
| Molecular Weight |
223.169 g/mol |
| Quality |
195 |
| Reported Formula |
C7H4F3NO2S |
| SMILES |
C1(SC(F)(F)F)=CC=C(C=C1)[N+]([O-])=O |
| SPLASH |
splash10-0f89-2900000000-ce053ee23800b0d9ac00 |
| Source of Spectrum |
QE-22-SM12-3t (DOI: 10.1002/chem.201503524) |
| Wiley ID |
1902950 |
