| SpectraBase Compound ID | FDYpAEuKxCN |
|---|---|
| InChI | InChI=1S/C11H16F3NO3/c1-3-5-7-18-9(16)8(6-4-2)15-10(17)11(12,13)14/h4,8H,2-3,5-7H2,1H3,(H,15,17) |
| InChIKey | ABNXWMBMRYQNRV-UHFFFAOYSA-N |
| Mol Weight | 267.25 g/mol |
| Molecular Formula | C11H16F3NO3 |
| Exact Mass | 267.108228 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I7W7raPEHYo |
|---|---|
| Name | D-Allylglycine, N-trifluoroacetyl-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.108227865 u |
| Formula | C11H16F3NO3 |
| InChI | InChI=1S/C11H16F3NO3/c1-3-5-7-18-9(16)8(6-4-2)15-10(17)11(12,13)14/h4,8H,2-3,5-7H2,1H3,(H,15,17) |
| InChIKey | ABNXWMBMRYQNRV-UHFFFAOYSA-N |
| Molecular Weight | 267.248 g/mol |
| SMILES | CCCCOC(C(NC(C(F)(F)F)=O)CC=C)=O |