| SpectraBase Compound ID | D53RVBZv3fN |
|---|---|
| InChI | InChI=1S/C14H27NO4/c1-6-7-8-9-10-19-13(16)12(11(2)3)15(4)14(17)18-5/h11-12H,6-10H2,1-5H3 |
| InChIKey | LHEAQINAWSLLLR-UHFFFAOYSA-N |
| Mol Weight | 273.37 g/mol |
| Molecular Formula | C14H27NO4 |
| Exact Mass | 273.194008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BLABhtZJQ8l |
|---|---|
| Name | Valine, N-methyl-N-methoxycarbonyl-, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.194008349 u |
| Formula | C14H27NO4 |
| InChI | InChI=1S/C14H27NO4/c1-6-7-8-9-10-19-13(16)12(11(2)3)15(4)14(17)18-5/h11-12H,6-10H2,1-5H3 |
| InChIKey | LHEAQINAWSLLLR-UHFFFAOYSA-N |
| SMILES | COC(N(C(C(OCCCCCC)=O)C(C)C)C)=O |