| SpectraBase Compound ID | AAnDiLVExw9 |
|---|---|
| InChI | InChI=1S/C20H39NO4/c1-8-9-10-11-12-13-14-24-18(22)17(16(2)3)21(7)19(23)25-15-20(4,5)6/h16-17H,8-15H2,1-7H3 |
| InChIKey | DXSUUERWFYRBRL-UHFFFAOYSA-N |
| Mol Weight | 357.5 g/mol |
| Molecular Formula | C20H39NO4 |
| Exact Mass | 357.287909 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 | FYHXowFx0cP |
|---|---|
| Name | Valine, N-methyl-N-neopentyloxycarbonyl-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 357.287908736 u |
| Formula | C20H39NO4 |
| InChI | InChI=1S/C20H39NO4/c1-8-9-10-11-12-13-14-24-18(22)17(16(2)3)21(7)19(23)25-15-20(4,5)6/h16-17H,8-15H2,1-7H3 |
| InChIKey | DXSUUERWFYRBRL-UHFFFAOYSA-N |
| Molecular Weight | 357.535 g/mol |
| SMILES | CC(COC(N(C(C(OCCCCCCCC)=O)C(C)C)C)=O)(C)C |