| SpectraBase Compound ID | LK3UO5Cvx7S |
|---|---|
| InChI | InChI=1S/C12H20F2O3/c1-3-17-11(16)7-9-12(13,14)8-5-4-6-10(2)15/h3-9H2,1-2H3 |
| InChIKey | IPPXAKLAZYAUGY-UHFFFAOYSA-N |
| Mol Weight | 250.29 g/mol |
| Molecular Formula | C12H20F2O3 |
| Exact Mass | 250.138051 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 | 299fRGiQSt2 |
|---|---|
| Name | Ethyl 4,4-difluoro-9-oxodecanoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.138050827 u |
| Formula | C12H20F2O3 |
| InChI | InChI=1S/C12H20F2O3/c1-3-17-11(16)7-9-12(13,14)8-5-4-6-10(2)15/h3-9H2,1-2H3 |
| InChIKey | IPPXAKLAZYAUGY-UHFFFAOYSA-N |
| Molecular Weight | 250.286 g/mol |
| SMILES | C(CCC(CCCCC(C)=O)(F)F)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.954789 |