![4-[(Trifluoromethyl)sulfanyl]benzoic acid](/api/spectrum/EN4DyHtLvFN/structure.png?h=300&w=458 "4-[(Trifluoromethyl)sulfanyl]benzoic acid")
| SpectraBase Compound ID | 2JytqbMj8pA |
|---|---|
| InChI | InChI=1S/C8H5F3O2S/c9-8(10,11)14-6-3-1-5(2-4-6)7(12)13/h1-4H,(H,12,13) |
| InChIKey | UMOGQQWVQUQTQA-UHFFFAOYSA-N |
| Mol Weight | 222.18 g/mol |
| Molecular Formula | C8H5F3O2S |
| Exact Mass | 221.996235 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | EN4DyHtLvFN |
|---|---|
| Name | 4-(Trifluoromethylthio)benzoic acid |
| Source of Sample | Aldrich |
| Catalog Number | 555487 |
| CAS Registry Number | 330-17-6 |
| Copyright | Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5F3O2S |
| InChI | InChI=1S/C8H5F3O2S/c9-8(10,11)14-6-3-1-5(2-4-6)7(12)13/h1-4H,(H,12,13) |
| InChIKey | UMOGQQWVQUQTQA-UHFFFAOYSA-N |
| Purity | 97% |
| Wiley ID | SIAL_ATR-IR_038431 |