| SpectraBase Compound ID | 3chJbk3UHRD |
|---|---|
| InChI | InChI=1S/C15H27NO3/c1-6-7-8-9-19-15(18)14(12(4)5)16-13(17)10-11(2)3/h10,12,14H,6-9H2,1-5H3,(H,16,17) |
| InChIKey | WXYZMYGLZXHHNJ-UHFFFAOYSA-N |
| Mol Weight | 269.38 g/mol |
| Molecular Formula | C15H27NO3 |
| Exact Mass | 269.199094 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FNJ1vIiJCav |
|---|---|
| Name | L-Valine, N-(3-methylbut-2-enoyl)-, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.199093730 u |
| Formula | C15H27NO3 |
| InChI | InChI=1S/C15H27NO3/c1-6-7-8-9-19-15(18)14(12(4)5)16-13(17)10-11(2)3/h10,12,14H,6-9H2,1-5H3,(H,16,17) |
| InChIKey | WXYZMYGLZXHHNJ-UHFFFAOYSA-N |
| Molecular Weight | 269.385 g/mol |
| SMILES | C(C(C(=O)OCCCCC)NC(=O)C=C(C)C)(C)C |