| SpectraBase Compound ID | EGP7wtT2Q2o |
|---|---|
| InChI | InChI=1S/C14H14F3NO3/c1-21-13(20)11-7-4-8-18(11)12(19)9-5-2-3-6-10(9)14(15,16)17/h2-3,5-6,11H,4,7-8H2,1H3 |
| InChIKey | TWHMHMAXBGTGGF-UHFFFAOYSA-N |
| Mol Weight | 301.27 g/mol |
| Molecular Formula | C14H14F3NO3 |
| Exact Mass | 301.092578 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GwgTROj40hQ |
|---|---|
| Name | L-Proline, N-(2-trifluoromethylbenzoyl)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.092577801 u |
| Formula | C14H14F3NO3 |
| InChI | InChI=1S/C14H14F3NO3/c1-21-13(20)11-7-4-8-18(11)12(19)9-5-2-3-6-10(9)14(15,16)17/h2-3,5-6,11H,4,7-8H2,1H3 |
| InChIKey | TWHMHMAXBGTGGF-UHFFFAOYSA-N |
| Molecular Weight | 301.265 g/mol |
| SMILES | C1CCC(N1C(=O)C1=C(C(F)(F)F)C=CC=C1)C(OC)=O |