| SpectraBase Compound ID | IGkGLm7lZRC |
|---|---|
| InChI | InChI=1S/C23H45NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28-22(25)21(2)24-23(26)27-3/h21H,4-20H2,1-3H3,(H,24,26) |
| InChIKey | NUWJBAMEUMRHMG-UHFFFAOYSA-N |
| Mol Weight | 399.6 g/mol |
| Molecular Formula | C23H45NO4 |
| Exact Mass | 399.334859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6Knbmtj92NL |
|---|---|
| Name | L-Alanine, N-methoxycarbonyl-, octadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 399.334858929 u |
| Formula | C23H45NO4 |
| InChI | InChI=1S/C23H45NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28-22(25)21(2)24-23(26)27-3/h21H,4-20H2,1-3H3,(H,24,26) |
| InChIKey | NUWJBAMEUMRHMG-UHFFFAOYSA-N |
| Molecular Weight | 399.616 g/mol |
| SMILES | COC(=O)NC(C)C(OCCCCCCCCCCCCCCCCCC)=O |