| SpectraBase Compound ID | 9c9fMdMyMt2 |
|---|---|
| InChI | InChI=1S/C22H43NO4/c1-7-8-9-10-11-12-13-14-15-16-26-21(24)20(19(4)5)23(6)22(25)27-17-18(2)3/h18-20H,7-17H2,1-6H3 |
| InChIKey | PKMMOJNGZYUEMC-UHFFFAOYSA-N |
| Mol Weight | 385.6 g/mol |
| Molecular Formula | C22H43NO4 |
| Exact Mass | 385.319209 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 | 2ZsvOEg8VMy |
|---|---|
| Name | Valine, N-methyl-N-isobutoxycarbonyl-, undecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 385.319208865 u |
| Formula | C22H43NO4 |
| InChI | InChI=1S/C22H43NO4/c1-7-8-9-10-11-12-13-14-15-16-26-21(24)20(19(4)5)23(6)22(25)27-17-18(2)3/h18-20H,7-17H2,1-6H3 |
| InChIKey | PKMMOJNGZYUEMC-UHFFFAOYSA-N |
| Molecular Weight | 385.589 g/mol |
| SMILES | CC(C)COC(N(C(C(OCCCCCCCCCCC)=O)C(C)C)C)=O |