SpectraBase Spectrum ID |
BTY9aCVbACf |
Name |
2-[(trifluoromethyl)thio]-3-hydroxypropanoic acid ethyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
218.022449810 u |
Formula |
C6H9F3O3S |
InChI |
InChI=1S/C6H9F3O3S/c1-2-12-5(11)4(3-10)13-6(7,8)9/h4,10H,2-3H2,1H3 |
InChIKey |
FKAFDSDRNSBBIQ-UHFFFAOYSA-N |
Instrument Name |
Varian Saturn 2100 T |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201602730 |
Molecular Weight |
218.190 g/mol |
Quality |
210 |
SMILES |
OCC(SC(F)(F)F)C(=O)OCC |
SPLASH |
splash10-00dl-9000000000-6f4e723cb3e22b10fc1b |
Source of Spectrum |
QE-22-SM19-2i (DOI: 10.1002/chem.201602730) |
Wiley ID |
1905004 |