| SpectraBase Spectrum ID |
ETzBNcoN7bL |
| Name |
Ethyl 2-((3-(trifluoromethyl)benzyl)thio)acetate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13F3O2S |
| InChI |
InChI=1S/C12H13F3O2S/c1-2-17-11(16)8-18-7-9-4-3-5-10(6-9)12(13,14)15/h3-6H,2,7-8H2,1H3 |
| InChIKey |
CZFGYFFDPUMPTF-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GC-MSQP2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.17.24 |
| Molecular Weight |
278.289 g/mol |
| Reported Formula |
C12H13F3O2S |
| SMILES |
c1ccc(cc1C(F)(F)F)CSCC(OCC)=O |
| SPLASH |
splash10-0a4u-3910000000-a0abbf1c60cec30342d5 |
| Source of Spectrum |
BJO-17-SM4-3d |
| Wiley ID |
1858427 |
