| SpectraBase Compound ID | 4EvCuwJ2fR1 |
|---|---|
| InChI | InChI=1S/C15H27NO4/c1-6-8-9-11-19-14(17)13(12(3)4)16(5)15(18)20-10-7-2/h7,12-13H,2,6,8-11H2,1,3-5H3 |
| InChIKey | LTFOCEPHYFKDMD-UHFFFAOYSA-N |
| Mol Weight | 285.38 g/mol |
| Molecular Formula | C15H27NO4 |
| Exact Mass | 285.194008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AGaBW4yZTqk |
|---|---|
| Name | Valine, N-methyl-N-allyloxycarbonyl-, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.194008349 u |
| Formula | C15H27NO4 |
| InChI | InChI=1S/C15H27NO4/c1-6-8-9-11-19-14(17)13(12(3)4)16(5)15(18)20-10-7-2/h7,12-13H,2,6,8-11H2,1,3-5H3 |
| InChIKey | LTFOCEPHYFKDMD-UHFFFAOYSA-N |
| SMILES | C=CCOC(N(C(C(C)C)C(OCCCCC)=O)C)=O |