| SpectraBase Compound ID | FEl6ucQdTCz |
|---|---|
| InChI | InChI=1S/C21H35NO3/c1-6-16(4)14-22-20(21(23)24-8-3)13-18-9-11-19(12-10-18)25-15-17(5)7-2/h9-12,16-17,20,22H,6-8,13-15H2,1-5H3 |
| InChIKey | XSWSJUHRXSCASR-UHFFFAOYSA-N |
| Mol Weight | 349.5 g/mol |
| Molecular Formula | C21H35NO3 |
| Exact Mass | 349.261694 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4F5ckrzfFjp |
|---|---|
| Name | L-Tyrosine, N,o-di(2-methylbutyl)-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 349.261693988 u |
| Formula | C21H35NO3 |
| InChI | InChI=1S/C21H35NO3/c1-6-16(4)14-22-20(21(23)24-8-3)13-18-9-11-19(12-10-18)25-15-17(5)7-2/h9-12,16-17,20,22H,6-8,13-15H2,1-5H3 |
| InChIKey | XSWSJUHRXSCASR-UHFFFAOYSA-N |
| Molecular Weight | 349.515 g/mol |
| SMILES | C1(=CC=C(C=C1)OCC(CC)C)CC(C(=O)OCC)NCC(CC)C |