| SpectraBase Spectrum ID |
FcQ8JIAxlun |
| Name |
2-[(trifluoromethyl)thio]-3-(4-hydroxyphenyl)propanoic acid methyl ester |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
280.038099874 u |
| Formula |
C11H11F3O3S |
| InChI |
InChI=1S/C11H11F3O3S/c1-17-10(16)9(18-11(12,13)14)6-7-2-4-8(15)5-3-7/h2-5,9,15H,6H2,1H3 |
| InChIKey |
HMXMZMHAMOWZEV-UHFFFAOYSA-N |
| Instrument Name |
Varian Saturn 2100 T |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201602730 |
| Molecular Weight |
280.261 g/mol |
| Quality |
169 |
| Reported Formula |
C11H11O3F3S |
| SMILES |
OC1=CC=C(CC(SC(F)(F)F)C(=O)OC)C=C1 |
| SPLASH |
splash10-0a4i-3900000000-740652454ad9b05f4f56 |
| Source of Spectrum |
QE-22-SM19-2j (DOI: 10.1002/chem.201602730) |
| Wiley ID |
1905005 |
![2-[(trifluoromethyl)thio]-3-(4-hydroxyphenyl)propanoic acid methyl ester](/api/spectrum/FcQ8JIAxlun/structure.png?h=300&w=458 "2-[(trifluoromethyl)thio]-3-(4-hydroxyphenyl)propanoic acid methyl ester")
