| SpectraBase Compound ID | DgWNKLAtOby |
|---|---|
| InChI | InChI=1S/C5H8F4O/c1-4(2,10)5(8,9)3(6)7/h3,10H,1-2H3 |
| InChIKey | NCMPMCXQKBZXGI-UHFFFAOYSA-N |
| Mol Weight | 160.11 g/mol |
| Molecular Formula | C5H8F4O |
| Exact Mass | 160.051128 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | DOxc1pqESUx |
|---|---|
| Name | 2-Methyl-3,3,4,4-tetrafluoro-2-butanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 160.051127529 u |
| Formula | C5H8F4O |
| InChI | InChI=1S/C5H8F4O/c1-4(2,10)5(8,9)3(6)7/h3,10H,1-2H3 |
| InChIKey | NCMPMCXQKBZXGI-UHFFFAOYSA-N |
| Molecular Weight | 160.112 g/mol |
| SMILES | OC(C(C(F)F)(F)F)(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.902471 |