| SpectraBase Compound ID | 83XqPS15UUR |
|---|---|
| InChI | InChI=1S/C14H26ClNO3/c1-4-5-10-19-14(18)13(11(2)3)16-12(17)8-6-7-9-15/h11,13H,4-10H2,1-3H3,(H,16,17) |
| InChIKey | WCEGVVOWCOOSRY-UHFFFAOYSA-N |
| Mol Weight | 291.82 g/mol |
| Molecular Formula | C14H26ClNO3 |
| Exact Mass | 291.160121 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FeoeVvfAEIO |
|---|---|
| Name | L-Valine, N-(5-chlorovaleryl)-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.160121398 u |
| Formula | C14H26ClNO3 |
| InChI | InChI=1S/C14H26ClNO3/c1-4-5-10-19-14(18)13(11(2)3)16-12(17)8-6-7-9-15/h11,13H,4-10H2,1-3H3,(H,16,17) |
| InChIKey | WCEGVVOWCOOSRY-UHFFFAOYSA-N |
| SMILES | C(CCCC(NC(C(C)C)C(OCCCC)=O)=O)Cl |