| SpectraBase Compound ID | IoDWQ7dGksa |
|---|---|
| InChI | InChI=1S/C17H33NO4/c1-4-7-9-11-14-22-17(20)18-15(12-6-3)16(19)21-13-10-8-5-2/h15H,4-14H2,1-3H3,(H,18,20)/t15-/m0/s1 |
| InChIKey | CSEQBBGYISLISV-HNNXBMFYSA-N |
| Mol Weight | 315.5 g/mol |
| Molecular Formula | C17H33NO4 |
| Exact Mass | 315.240959 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BBAusI77d1i |
|---|---|
| Name | L-Norvaline, N-hexyloxycarbonyl-, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.240958543 u |
| Formula | C17H33NO4 |
| InChI | InChI=1S/C17H33NO4/c1-4-7-9-11-14-22-17(20)18-15(12-6-3)16(19)21-13-10-8-5-2/h15H,4-14H2,1-3H3,(H,18,20)/t15-/m0/s1 |
| InChIKey | CSEQBBGYISLISV-HNNXBMFYSA-N |
| Molecular Weight | 315.454 g/mol |
| SMILES | CCC[C@@](C(OCCCCC)=O)(NC(=O)OCCCCCC)[H] |