| SpectraBase Compound ID | 608WGoGQXWN |
|---|---|
| InChI | InChI=1S/C13H19NO2/c1-3-9-16-12(15)13(2,14)10-11-7-5-4-6-8-11/h4-8H,3,9-10,14H2,1-2H3 |
| InChIKey | QQBLGPLTKCAKQP-UHFFFAOYSA-N |
| Mol Weight | 221.3 g/mol |
| Molecular Formula | C13H19NO2 |
| Exact Mass | 221.141579 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DzvWFJq6z92 |
|---|---|
| Name | Phenylalanine, dl, .alpha.-methyl-, N-propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.141578854 u |
| Formula | C13H19NO2 |
| InChI | InChI=1S/C13H19NO2/c1-3-9-16-12(15)13(2,14)10-11-7-5-4-6-8-11/h4-8H,3,9-10,14H2,1-2H3 |
| InChIKey | QQBLGPLTKCAKQP-UHFFFAOYSA-N |
| Molecular Weight | 221.300 g/mol |
| SMILES | C1(=CC=CC=C1)CC(C)(N)C(=O)OCCC |