| SpectraBase Compound ID | 7yC6MJjqfPc |
|---|---|
| InChI | InChI=1S/C12H24N2O2/c1-6-7-8-16-12(15)11(10(2)3)13-9-14(4)5/h9-11H,6-8H2,1-5H3/b13-9+ |
| InChIKey | CIQLNMPTUROYST-UKTHLTGXSA-N |
| Mol Weight | 228.34 g/mol |
| Molecular Formula | C12H24N2O2 |
| Exact Mass | 228.183778 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FjbgsS3nn4w |
|---|---|
| Name | L-Valine, N-dimethylaminomethylene-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.183778019 u |
| Formula | C12H24N2O2 |
| InChI | InChI=1S/C12H24N2O2/c1-6-7-8-16-12(15)11(10(2)3)13-9-14(4)5/h9-11H,6-8H2,1-5H3/b13-9+ |
| InChIKey | CIQLNMPTUROYST-UKTHLTGXSA-N |
| Molecular Weight | 228.336 g/mol |
| SMILES | C(C(C(OCCCC)=O)\N=C\N(C)C)(C)C |