| SpectraBase Compound ID | BqjdCbauzjb |
|---|---|
| InChI | InChI=1S/C14H16F3NO4/c1-3-22-12(19)11(18-13(20)14(15,16)17)8-9-4-6-10(21-2)7-5-9/h4-7,11H,3,8H2,1-2H3,(H,18,20) |
| InChIKey | DPOUBKSWOYWMNW-UHFFFAOYSA-N |
| Mol Weight | 319.28 g/mol |
| Molecular Formula | C14H16F3NO4 |
| Exact Mass | 319.103142 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2jExuepMIg2 |
|---|---|
| Name | L-Tyrosine, N-trifluoroacetyl-o-methyl-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 319.103142484 u |
| Formula | C14H16F3NO4 |
| InChI | InChI=1S/C14H16F3NO4/c1-3-22-12(19)11(18-13(20)14(15,16)17)8-9-4-6-10(21-2)7-5-9/h4-7,11H,3,8H2,1-2H3,(H,18,20) |
| InChIKey | DPOUBKSWOYWMNW-UHFFFAOYSA-N |
| Molecular Weight | 319.280 g/mol |
| SMILES | C1(=CC=C(C=C1)OC)CC(C(=O)OCC)NC(C(F)(F)F)=O |