| SpectraBase Compound ID | ItquRv47dWV |
|---|---|
| InChI | InChI=1S/C17H31NO3/c1-3-4-5-6-7-10-13-21-17(20)14(2)18-16(19)15-11-8-9-12-15/h14-15H,3-13H2,1-2H3,(H,18,19) |
| InChIKey | PWPPRLMDMNHNNH-UHFFFAOYSA-N |
| Mol Weight | 297.44 g/mol |
| Molecular Formula | C17H31NO3 |
| Exact Mass | 297.230394 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1ebQUkwn70r |
|---|---|
| Name | L-Alanine, N-(cyclopentylcarbonyl)-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.230393859 u |
| Formula | C17H31NO3 |
| InChI | InChI=1S/C17H31NO3/c1-3-4-5-6-7-10-13-21-17(20)14(2)18-16(19)15-11-8-9-12-15/h14-15H,3-13H2,1-2H3,(H,18,19) |
| InChIKey | PWPPRLMDMNHNNH-UHFFFAOYSA-N |
| SMILES | C1CCCC1C(=O)NC(C(OCCCCCCCC)=O)C |