| SpectraBase Compound ID | FwvPV57khrZ |
|---|---|
| InChI | InChI=1S/C16H31NO4/c1-11(2)12(13(18)20-9-15(3,4)5)17-14(19)21-10-16(6,7)8/h11-12H,9-10H2,1-8H3,(H,17,19) |
| InChIKey | UZOUMPVHQXVLHU-UHFFFAOYSA-N |
| Mol Weight | 301.43 g/mol |
| Molecular Formula | C16H31NO4 |
| Exact Mass | 301.225308 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 | 8aUhLk1y6t8 |
|---|---|
| Name | L-Valine, N-neopentyloxycarbonyl-, neopentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.225308478 u |
| Formula | C16H31NO4 |
| InChI | InChI=1S/C16H31NO4/c1-11(2)12(13(18)20-9-15(3,4)5)17-14(19)21-10-16(6,7)8/h11-12H,9-10H2,1-8H3,(H,17,19) |
| InChIKey | UZOUMPVHQXVLHU-UHFFFAOYSA-N |
| SMILES | C(COC(C(NC(OCC(C)(C)C)=O)C(C)C)=O)(C)(C)C |