| SpectraBase Compound ID | 2QolPtflXRK |
|---|---|
| InChI | InChI=1S/C18H33NO4/c1-4-6-7-8-9-10-11-12-13-15-22-17(20)16(3)19-18(21)23-14-5-2/h5,16H,2,4,6-15H2,1,3H3,(H,19,21) |
| InChIKey | OVJFYNCZIOCSJK-UHFFFAOYSA-N |
| Mol Weight | 327.5 g/mol |
| Molecular Formula | C18H33NO4 |
| Exact Mass | 327.240959 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4poqkLnlrYK |
|---|---|
| Name | D-Alanine, N-allyloxycarbonyl-, undecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 327.240958543 u |
| Formula | C18H33NO4 |
| InChI | InChI=1S/C18H33NO4/c1-4-6-7-8-9-10-11-12-13-15-22-17(20)16(3)19-18(21)23-14-5-2/h5,16H,2,4,6-15H2,1,3H3,(H,19,21) |
| InChIKey | OVJFYNCZIOCSJK-UHFFFAOYSA-N |
| Molecular Weight | 327.465 g/mol |
| SMILES | CC(NC(OCC=C)=O)C(OCCCCCCCCCCC)=O |