| SpectraBase Compound ID | 820abYRQdXI |
|---|---|
| InChI | InChI=1S/C17H25NO4/c1-3-5-9-12-22-16(19)15(18-17(20)21-4-2)13-14-10-7-6-8-11-14/h6-8,10-11,15H,3-5,9,12-13H2,1-2H3,(H,18,20) |
| InChIKey | ZMXCKMXCTKLATA-UHFFFAOYSA-N |
| Mol Weight | 307.39 g/mol |
| Molecular Formula | C17H25NO4 |
| Exact Mass | 307.178358 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1aO6YzLyDNx |
|---|---|
| Name | L-Phenylalanine, N-ethoxycarbonyl-, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.178358285 u |
| Formula | C17H25NO4 |
| InChI | InChI=1S/C17H25NO4/c1-3-5-9-12-22-16(19)15(18-17(20)21-4-2)13-14-10-7-6-8-11-14/h6-8,10-11,15H,3-5,9,12-13H2,1-2H3,(H,18,20) |
| InChIKey | ZMXCKMXCTKLATA-UHFFFAOYSA-N |
| Molecular Weight | 307.390 g/mol |
| SMILES | CCOC(NC(C(OCCCCC)=O)CC1=CC=CC=C1)=O |