| SpectraBase Spectrum ID |
IUqhef7opaM |
| Name |
2,5-Dimethoxythiophenol, S-trifluoroacetyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.022449810 u |
| Formula |
C10H9F3O3S |
| InChI |
InChI=1S/C10H9F3O3S/c1-15-6-3-4-7(16-2)8(5-6)17-9(14)10(11,12)13/h3-5H,1-2H3 |
| InChIKey |
WUEYLQFIYYKXDQ-UHFFFAOYSA-N |
| Molecular Weight |
266.234 g/mol |
| SMILES |
C1(SC(C(F)(F)F)=O)=C(C=CC(=C1)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919983 |
