| SpectraBase Compound ID | BaULEREK6y4 |
|---|---|
| InChI | InChI=1S/C22H41NO4/c1-6-8-9-10-11-12-13-14-15-17-26-21(24)20(18-19(3)4)23(5)22(25)27-16-7-2/h7,19-20H,2,6,8-18H2,1,3-5H3 |
| InChIKey | MXQJQFSFIONWLJ-UHFFFAOYSA-N |
| Mol Weight | 383.6 g/mol |
| Molecular Formula | C22H41NO4 |
| Exact Mass | 383.303559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 14C3RquGohI |
|---|---|
| Name | L-Leucine, N-allyloxycarbonyl-N-methyl-, undecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 383.303558800 u |
| Formula | C22H41NO4 |
| InChI | InChI=1S/C22H41NO4/c1-6-8-9-10-11-12-13-14-15-17-26-21(24)20(18-19(3)4)23(5)22(25)27-16-7-2/h7,19-20H,2,6,8-18H2,1,3-5H3 |
| InChIKey | MXQJQFSFIONWLJ-UHFFFAOYSA-N |
| Molecular Weight | 383.573 g/mol |
| SMILES | C=CCOC(N(C(C(OCCCCCCCCCCC)=O)CC(C)C)C)=O |