| SpectraBase Compound ID | 60sKu6YEdlK |
|---|---|
| InChI | InChI=1S/C15H29NO4/c1-7-19-15(18)16(6)13(12(4)5)14(17)20-10-8-9-11(2)3/h11-13H,7-10H2,1-6H3 |
| InChIKey | LAISOEAOPPPXER-UHFFFAOYSA-N |
| Mol Weight | 287.4 g/mol |
| Molecular Formula | C15H29NO4 |
| Exact Mass | 287.209658 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LRThVgLhVQw |
|---|---|
| Name | Valine, N-methyl-N-ethoxycarbonyl-, isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.209658414 u |
| Formula | C15H29NO4 |
| InChI | InChI=1S/C15H29NO4/c1-7-19-15(18)16(6)13(12(4)5)14(17)20-10-8-9-11(2)3/h11-13H,7-10H2,1-6H3 |
| InChIKey | LAISOEAOPPPXER-UHFFFAOYSA-N |
| SMILES | CCOC(N(C(C(OCCCC(C)C)=O)C(C)C)C)=O |