| SpectraBase Compound ID | BfTgmANbocu |
|---|---|
| InChI | InChI=1S/C14H16F3NO3/c1-10(12(19)21-2)8-18(13(20)14(15,16)17)9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3 |
| InChIKey | JKIVLCSFGFRWPM-UHFFFAOYSA-N |
| Mol Weight | 303.28 g/mol |
| Molecular Formula | C14H16F3NO3 |
| Exact Mass | 303.108228 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DsYu3bqy7aR |
|---|---|
| Name | 2-Methyl-.beta.-alanine, N-benzyl-N-trifluoroacetyl-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.108227865 u |
| Formula | C14H16F3NO3 |
| InChI | InChI=1S/C14H16F3NO3/c1-10(12(19)21-2)8-18(13(20)14(15,16)17)9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3 |
| InChIKey | JKIVLCSFGFRWPM-UHFFFAOYSA-N |
| Molecular Weight | 303.281 g/mol |
| SMILES | C1=CC=C(C=C1)CN(CC(C(OC)=O)C)C(C(F)(F)F)=O |