| SpectraBase Compound ID | Lizj7SiX4P0 |
|---|---|
| InChI | InChI=1S/C17H33NO4/c1-7-8-9-10-11-21-15(19)14(13(2)3)18-16(20)22-12-17(4,5)6/h13-14H,7-12H2,1-6H3,(H,18,20) |
| InChIKey | BIYMKOIHBKMIEC-UHFFFAOYSA-N |
| Mol Weight | 315.5 g/mol |
| Molecular Formula | C17H33NO4 |
| Exact Mass | 315.240959 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 | 2CqMRETLiEX |
|---|---|
| Name | L-Valine, N-neopentyloxycarbonyl-, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.240958543 u |
| Formula | C17H33NO4 |
| InChI | InChI=1S/C17H33NO4/c1-7-8-9-10-11-21-15(19)14(13(2)3)18-16(20)22-12-17(4,5)6/h13-14H,7-12H2,1-6H3,(H,18,20) |
| InChIKey | BIYMKOIHBKMIEC-UHFFFAOYSA-N |
| Molecular Weight | 315.454 g/mol |
| SMILES | CCCCCCOC(C(NC(OCC(C)(C)C)=O)C(C)C)=O |