| SpectraBase Compound ID | 8nnwV45mh7N |
|---|---|
| InChI | InChI=1S/C17H25NO4/c1-4-5-9-12-21-16(19)14(2)18(3)17(20)22-13-15-10-7-6-8-11-15/h6-8,10-11,14H,4-5,9,12-13H2,1-3H3 |
| InChIKey | GZUITGYIEDOEOL-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 | FChWEnmB2Ev |
|---|---|
| Name | Alanine, N-methyl-N-benzyloxycarbonyl-, 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/c1-4-5-9-12-21-16(19)14(2)18(3)17(20)22-13-15-10-7-6-8-11-15/h6-8,10-11,14H,4-5,9,12-13H2,1-3H3 |
| InChIKey | GZUITGYIEDOEOL-UHFFFAOYSA-N |
| Molecular Weight | 307.390 g/mol |
| SMILES | C1=CC=CC=C1COC(N(C(C(OCCCCC)=O)C)C)=O |