| SpectraBase Compound ID | 4rzDQ3eQ7Fd |
|---|---|
| InChI | InChI=1S/C22H41NO3/c1-4-6-8-10-11-12-13-15-17-19-26-22(25)20(3)23-21(24)18-16-14-9-7-5-2/h4,20H,1,5-19H2,2-3H3,(H,23,24) |
| InChIKey | ZAOOQFSNTXNMLC-UHFFFAOYSA-N |
| Mol Weight | 367.6 g/mol |
| Molecular Formula | C22H41NO3 |
| Exact Mass | 367.308644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CEaAlIM57NW |
|---|---|
| Name | L-Alanine, N-octanoyl-, undec-10-enyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 367.308644181 u |
| Formula | C22H41NO3 |
| InChI | InChI=1S/C22H41NO3/c1-4-6-8-10-11-12-13-15-17-19-26-22(25)20(3)23-21(24)18-16-14-9-7-5-2/h4,20H,1,5-19H2,2-3H3,(H,23,24) |
| InChIKey | ZAOOQFSNTXNMLC-UHFFFAOYSA-N |
| Molecular Weight | 367.574 g/mol |
| SMILES | CCCCCCCC(NC(C)C(OCCCCCCCCCC=C)=O)=O |