| SpectraBase Compound ID | 8LQsTwJSIAJ |
|---|---|
| InChI | InChI=1S/C10H9F8NO3/c11-8(12,10(16,17)18)4-22-6(20)5-2-1-3-19(5)7(21)9(13,14)15/h5H,1-4H2 |
| InChIKey | WUMSDKKXNIAXOC-UHFFFAOYSA-N |
| Mol Weight | 343.17 g/mol |
| Molecular Formula | C10H9F8NO3 |
| Exact Mass | 343.045468 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JrklwFNCPVQ |
|---|---|
| Name | L-Proline, N-trifluoroacetyl-, 2,2,3,3,3-pentafluoropropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 343.045468455 u |
| Formula | C10H9F8NO3 |
| InChI | InChI=1S/C10H9F8NO3/c11-8(12,10(16,17)18)4-22-6(20)5-2-1-3-19(5)7(21)9(13,14)15/h5H,1-4H2 |
| InChIKey | WUMSDKKXNIAXOC-UHFFFAOYSA-N |
| Molecular Weight | 343.173 g/mol |
| SMILES | C(OCC(C(F)(F)F)(F)F)(=O)C1CCCN1C(C(F)(F)F)=O |