| SpectraBase Compound ID | 40XBed3Qxtj |
|---|---|
| InChI | InChI=1S/C8H5F3O2/c9-8(10,11)13-7(12)6-4-2-1-3-5-6/h1-5H |
| InChIKey | WRTSXKKAXLYBSH-UHFFFAOYSA-N |
| Mol Weight | 190.12 g/mol |
| Molecular Formula | C8H5F3O2 |
| Exact Mass | 190.024164 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ANVcv89vnDy |
|---|---|
| Name | trifluoromethyl benzoate |
| Appearance | Colorless liquid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5F3O2 |
| InChI | InChI=1S/C8H5F3O2/c9-8(10,11)13-7(12)6-4-2-1-3-5-6/h1-5H |
| InChIKey | WRTSXKKAXLYBSH-UHFFFAOYSA-N |
| Ionization Type | EI |
| Molecular Weight | 190.121 g/mol |
| Reported Formula | C8H5F3O2 |
| SMILES | c1cc(ccc1)C(=O)OC(F)(F)F |
| SPLASH | splash10-0a6r-4900000000-8468f7f81ac097d79834 |
| Source of Spectrum | CN108516935A |
| Wiley ID | 1870579 |