| SpectraBase Spectrum ID |
Kaeoc0oDZGX |
| Name |
5,5,5-Trifluoro-4-hydroxy-3-(p-tolylthio)pentanoic acid |
| Alternate Name(s) |
2,5-Dideoxy-5,5,5-trifluoro-3-S-(4-methylphenyl)-3-thiopentonic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13F3O3S |
| InChI |
InChI=1S/C12H13F3O3S/c1-7-2-4-8(5-3-7)19-9(6-10(16)17)11(18)12(13,14)15/h2-5,9,11,18H,6H2,1H3,(H,16,17) |
| InChIKey |
ZCBVMNIXROQGRP-UHFFFAOYSA-N |
| Molecular Weight |
294.288 g/mol |
| SMILES |
OC(CC(C(C(F)(F)F)O)Sc1ccc(cc1)C)=O |
| SPLASH |
splash10-0006-0590000000-58284a0c39978689e605 |
| Source of Spectrum |
K1-2002-1899-6 |
| Wiley ID |
872343 |
