| SpectraBase Compound ID | 2Q0sdi8U9sI |
|---|---|
| InChI | InChI=1S/C19H35NO3/c1-4-6-8-9-10-11-12-13-14-16-23-19(22)17(3)20-18(21)15-7-5-2/h4,17H,1,5-16H2,2-3H3,(H,20,21) |
| InChIKey | FVJLPNRQQKNUOS-UHFFFAOYSA-N |
| Mol Weight | 325.5 g/mol |
| Molecular Formula | C19H35NO3 |
| Exact Mass | 325.261694 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DLi9HZbrPhD |
|---|---|
| Name | L-Alanine, N-valeryl-, undec-10-enyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 325.261693988 u |
| Formula | C19H35NO3 |
| InChI | InChI=1S/C19H35NO3/c1-4-6-8-9-10-11-12-13-14-16-23-19(22)17(3)20-18(21)15-7-5-2/h4,17H,1,5-16H2,2-3H3,(H,20,21) |
| InChIKey | FVJLPNRQQKNUOS-UHFFFAOYSA-N |
| Molecular Weight | 325.493 g/mol |
| SMILES | C(COC(C(NC(=O)CCCC)C)=O)CCCCCCCC=C |