| SpectraBase Spectrum ID |
6khahrEFudi |
| Name |
3-(tert-Butylthio)-4-chlorophenyl trifluoromethanesulfonate |
| Appearance |
Colourless liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
347.986848780 u |
| Formula |
C11H12ClF3O3S2 |
| GC Oven Program |
Oven temp 250oC |
| InChI |
InChI=1S/C11H12ClF3O3S2/c1-10(2,3)19-9-6-7(4-5-8(9)12)18-20(16,17)11(13,14)15/h4-6H,1-3H3 |
| InChIKey |
OJLSZKOUOKSOAD-UHFFFAOYSA-N |
| Inlet Type |
Split injector |
| Instrument Name |
Agilent Technologies 7820A GC-5975 series MSD |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201806036 |
| Molecular Weight |
348.782 g/mol |
| Quality |
260 |
| Reported Formula |
C11H12O3ClF3S2 |
| SMILES |
C=1(C=C(C=CC1Cl)OS(C(F)(F)F)(=O)=O)SC(C)(C)C |
| SPLASH |
splash10-0a4i-9030000000-dba684beeafd93e1b322 |
| Source of Spectrum |
ACI-57-SM18-39 (DOI: 10.1002/anie.201806036) |
| Thin-Layer Chromatography |
0.30 (hexane/EtOAc, 99:1) |
| Wiley ID |
1893399 |
