| SpectraBase Compound ID | 4hR1vHlNEF3 |
|---|---|
| InChI | InChI=1S/C12H12F3NO3/c1-2-19-10(17)8-16(11(18)12(13,14)15)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3 |
| InChIKey | QDSKSXFRMRAXOJ-UHFFFAOYSA-N |
| Mol Weight | 275.23 g/mol |
| Molecular Formula | C12H12F3NO3 |
| Exact Mass | 275.076928 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BdhphqsAC5R |
|---|---|
| Name | N-Trifluoroacetyl-N-phenylglycine, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.076927736 u |
| Formula | C12H12F3NO3 |
| InChI | InChI=1S/C12H12F3NO3/c1-2-19-10(17)8-16(11(18)12(13,14)15)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3 |
| InChIKey | QDSKSXFRMRAXOJ-UHFFFAOYSA-N |
| Molecular Weight | 275.227 g/mol |
| SMILES | C1=CC=CC(=C1)N(CC(=O)OCC)C(C(F)(F)F)=O |