| SpectraBase Compound ID | 3aeBsV6urEV |
|---|---|
| InChI | InChI=1S/C24H47NO4/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-20-28-23(26)22(21(3)4)25-24(27)29-19-6-2/h21-22H,5-20H2,1-4H3,(H,25,27) |
| InChIKey | CYGUFZFZTCSOKM-UHFFFAOYSA-N |
| Mol Weight | 413.6 g/mol |
| Molecular Formula | C24H47NO4 |
| Exact Mass | 413.350509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KzGsYbgRs5y |
|---|---|
| Name | L-Valine, N-propoxycarbonyl-, pentadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 413.350508993 u |
| Formula | C24H47NO4 |
| InChI | InChI=1S/C24H47NO4/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-20-28-23(26)22(21(3)4)25-24(27)29-19-6-2/h21-22H,5-20H2,1-4H3,(H,25,27) |
| InChIKey | CYGUFZFZTCSOKM-UHFFFAOYSA-N |
| Molecular Weight | 413.643 g/mol |
| SMILES | CCCOC(NC(C(OCCCCCCCCCCCCCCC)=O)C(C)C)=O |