| SpectraBase Spectrum ID |
9jPsMahR2kL |
| Name |
Methyl 3-butyl-4-(trifluoromethylsulfonyloxy)benzoate |
| Appearance |
Light yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.059229241 u |
| Formula |
C13H15F3O5S |
| InChI |
InChI=1S/C13H15F3O5S/c1-3-4-5-9-8-10(12(17)20-2)6-7-11(9)21-22(18,19)13(14,15)16/h6-8H,3-5H2,1-2H3 |
| InChIKey |
UXWWPUSJHMZYCP-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201701691 |
| Molecular Weight |
340.313 g/mol |
| Quality |
193 |
| Reported Formula |
C13H15F3O5S |
| SMILES |
C(CCC)C1=C(C=CC(=C1)C(=O)OC)OS(C(F)(F)F)(=O)=O |
| SPLASH |
splash10-00kf-1905000000-d7a69ddb91c492f8e37f |
| Source of Spectrum |
ACI-56-SM12-4b (DOI: 10.1002/anie.201701691) |
| Thin-Layer Chromatography |
0.44 (Hexane/EtOAc, 10:1) |
| Wiley ID |
1895984 |
