| SpectraBase Compound ID | AypRXHiwU7c |
|---|---|
| InChI | InChI=1S/C18H35NO3/c1-4-6-8-10-12-14-17(20)19-16(3)18(21)22-15-13-11-9-7-5-2/h16H,4-15H2,1-3H3,(H,19,20) |
| InChIKey | ZYQXEWCORMEPOB-UHFFFAOYSA-N |
| Mol Weight | 313.5 g/mol |
| Molecular Formula | C18H35NO3 |
| Exact Mass | 313.261694 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GTnIjczopLY |
|---|---|
| Name | L-Alanine, N-octanoyl-, heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 313.261693988 u |
| Formula | C18H35NO3 |
| InChI | InChI=1S/C18H35NO3/c1-4-6-8-10-12-14-17(20)19-16(3)18(21)22-15-13-11-9-7-5-2/h16H,4-15H2,1-3H3,(H,19,20) |
| InChIKey | ZYQXEWCORMEPOB-UHFFFAOYSA-N |
| SMILES | CCCCCCCC(NC(C)C(OCCCCCCC)=O)=O |