| SpectraBase Compound ID | ELCQQHF6G25 |
|---|---|
| InChI | InChI=1S/C5H6F4O2/c6-2-1-3-11-4(10)5(7,8)9/h1-3H2 |
| InChIKey | STEYFQOVBZLZSM-UHFFFAOYSA-N |
| Mol Weight | 174.09 g/mol |
| Molecular Formula | C5H6F4O2 |
| Exact Mass | 174.030392 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 | 50iGUY8VIyC |
|---|---|
| Name | 3-Fluoropropan-1-ol, trifluoroacetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.030392083 u |
| Formula | C5H6F4O2 |
| InChI | InChI=1S/C5H6F4O2/c6-2-1-3-11-4(10)5(7,8)9/h1-3H2 |
| InChIKey | STEYFQOVBZLZSM-UHFFFAOYSA-N |
| Molecular Weight | 174.095 g/mol |
| SMILES | C(CCF)OC(C(F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.920976 |