| SpectraBase Spectrum ID |
Jq9uXG85NWv |
| Name |
4-Chloro-3,5-dimethylphenyl trifluoromethanesulfonate |
| Appearance |
Colourless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
287.983477478 u |
| Formula |
C9H8ClF3O3S |
| InChI |
InChI=1S/C9H8ClF3O3S/c1-5-3-7(4-6(2)8(5)10)16-17(14,15)9(11,12)13/h3-4H,1-2H3 |
| InChIKey |
HEXWTFQGAAEVLL-UHFFFAOYSA-N |
| Instrument Name |
Agilent Technologies 7820A-5975 series MSD |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201808386 |
| Molecular Weight |
288.668 g/mol |
| Quality |
346 |
| SMILES |
C1(=CC(=C(C(=C1)C)Cl)C)OS(C(F)(F)F)(=O)=O |
| SPLASH |
splash10-0a6u-2930000000-311f37b9f8439ed64c5c |
| Source of Spectrum |
ACI-57-SM32-32-2 (DOI: 10.1002/anie.201808386) |
| Thin-Layer Chromatography |
0.65 (Hexane) |
| Wiley ID |
1893428 |
