| SpectraBase Compound ID | CqzoKTrx2LY |
|---|---|
| InChI | InChI=1S/C16H24F5NO3/c1-2-3-4-5-6-7-11-25-13(23)12-9-8-10-22(12)14(24)15(17,18)16(19,20)21/h12H,2-11H2,1H3 |
| InChIKey | IQETVZHKHOYRJR-UHFFFAOYSA-N |
| Mol Weight | 373.36 g/mol |
| Molecular Formula | C16H24F5NO3 |
| Exact Mass | 373.167634 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Shq5BdYKi |
|---|---|
| Name | L-Proline, N-pentafluoropropionyl-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 373.167634449 u |
| Formula | C16H24F5NO3 |
| InChI | InChI=1S/C16H24F5NO3/c1-2-3-4-5-6-7-11-25-13(23)12-9-8-10-22(12)14(24)15(17,18)16(19,20)21/h12H,2-11H2,1H3 |
| InChIKey | IQETVZHKHOYRJR-UHFFFAOYSA-N |
| Molecular Weight | 373.364 g/mol |
| SMILES | CCCCCCCCOC(C1N(C(C(C(F)(F)F)(F)F)=O)CCC1)=O |