| SpectraBase Compound ID | 1edh5N0b6Em |
|---|---|
| InChI | InChI=1S/C7H9F3O3/c8-7(9,10)6(11)13-4-5-2-1-3-12-5/h5H,1-4H2 |
| InChIKey | GOKZENBYBLZEGU-UHFFFAOYSA-N |
| Mol Weight | 198.14 g/mol |
| Molecular Formula | C7H9F3O3 |
| Exact Mass | 198.050379 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KT8m19XmlqE |
|---|---|
| Name | Trifluoroacetic acid, 2-tetrahydrofurylmethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.050378636 u |
| Formula | C7H9F3O3 |
| InChI | InChI=1S/C7H9F3O3/c8-7(9,10)6(11)13-4-5-2-1-3-12-5/h5H,1-4H2 |
| InChIKey | GOKZENBYBLZEGU-UHFFFAOYSA-N |
| Molecular Weight | 198.141 g/mol |
| SMILES | C(F)(C(=O)OCC1OCCC1)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.941008 |