| SpectraBase Compound ID | CHOOzGYKYSx |
|---|---|
| InChI | InChI=1S/C16H15NO4/c18-13-8-6-11(7-9-13)10-14(16(20)21)17-15(19)12-4-2-1-3-5-12/h1-9,14,18H,10H2,(H,17,19)(H,20,21) |
| InChIKey | KUUUDPTUEOKITK-UHFFFAOYSA-N |
| Mol Weight | 285.3 g/mol |
| Molecular Formula | C16H15NO4 |
| Exact Mass | 285.100108 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 45h6UQIYxb9 |
|---|---|
| Name | N-Benzoyltyrosine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.100107963 u |
| Formula | C16H15NO4 |
| InChI | InChI=1S/C16H15NO4/c18-13-8-6-11(7-9-13)10-14(16(20)21)17-15(19)12-4-2-1-3-5-12/h1-9,14,18H,10H2,(H,17,19)(H,20,21) |
| InChIKey | KUUUDPTUEOKITK-UHFFFAOYSA-N |
| SMILES | C1=C(C=CC(=C1)O)CC(C(O)=O)NC(=O)C1=CC=CC=C1 |