| SpectraBase Compound ID | Dx8BHD87Kfs |
|---|---|
| InChI | InChI=1S/C4H5F3O/c5-4(6,7)2-1-3-8/h1-2,8H,3H2/b2-1+ |
| InChIKey | UUTWQLLIVDODPQ-OWOJBTEDSA-N |
| Mol Weight | 126.08 g/mol |
| Molecular Formula | C4H5F3O |
| Exact Mass | 126.029249 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DjEeh0u6PJI |
|---|---|
| Name | 4,4,4-Trifluorobut-2-en-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 126.029249269 u |
| Formula | C4H5F3O |
| InChI | InChI=1S/C4H5F3O/c5-4(6,7)2-1-3-8/h1-2,8H,3H2/b2-1+ |
| InChIKey | UUTWQLLIVDODPQ-OWOJBTEDSA-N |
| Molecular Weight | 126.078 g/mol |
| SMILES | C(\C=C\C(F)(F)F)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.84977 |