| SpectraBase Spectrum ID |
5RuTYa71uXj |
| Name |
Methyl 3-(5-iodo-2-(((trifluoromethyl)sulfonyl)oxy)phenyl)propanoate |
| Appearance |
Colorless oil |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H10F3IO5S |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C11H10F3IO5S/c1-19-10(16)5-2-7-6-8(15)3-4-9(7)20-21(17,18)11(12,13)14/h3-4,6H,2,5H2,1H3 |
| InChIKey |
CQJIUDFAYXIORO-UHFFFAOYSA-N |
| Inlet Type |
Split |
| Instrument Name |
Agilent Technologies 7890A-5975C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202101278 |
| Molecular Weight |
438.156 g/mol |
| Quality |
150 |
| SMILES |
COC(CCC1=C(C=CC(=C1)I)OS(C(F)(F)F)(=O)=O)=O |
| SPLASH |
splash10-000i-3090100000-a0c1a78f6b495d14ebb3 |
| Source of Spectrum |
K1-2022-SM26-23 (DOI: 10.1002/ejoc.202101278) |
| Thin-Layer Chromatography |
0.26 (cyclohexane/EtOAc, 20:1) |
| Wiley ID |
1898545 |
