| SpectraBase Compound ID | 4MLixIIs93S |
|---|---|
| InChI | InChI=1S/C4H4F5NO/c1-10-2(11)3(5,6)4(7,8)9/h1H3,(H,10,11) |
| InChIKey | CSZPEWBLUWPQBM-UHFFFAOYSA-N |
| Mol Weight | 177.07 g/mol |
| Molecular Formula | C4H4F5NO |
| Exact Mass | 177.021305 g/mol |
| SpectraBase Spectrum ID | ARv2zt46sk6 |
|---|---|
| Name | Methylamine, N-pentafluoropropionyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 177.021304567 u |
| Formula | C4H4F5NO |
| InChI | InChI=1S/C4H4F5NO/c1-10-2(11)3(5,6)4(7,8)9/h1H3,(H,10,11) |
| InChIKey | CSZPEWBLUWPQBM-UHFFFAOYSA-N |
| Molecular Weight | 177.074 g/mol |
| SMILES | C(F)(C(=O)NC)(C(F)(F)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.915226 |