| SpectraBase Compound ID | FEukDnnRBIf |
|---|---|
| InChI | InChI=1S/C12H23NO3/c1-8(2)7-10(14)13(5)11(9(3)4)12(15)16-6/h8-9,11H,7H2,1-6H3 |
| InChIKey | AIWKNOBGZBWGCY-UHFFFAOYSA-N |
| Mol Weight | 229.32 g/mol |
| Molecular Formula | C12H23NO3 |
| Exact Mass | 229.167794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4rFfKu4hy1q |
|---|---|
| Name | 3-Methyl-2-(3-methylbutanoylamino)butanoic acid, 2me derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 229.167793602 u |
| Formula | C12H23NO3 |
| InChI | InChI=1S/C12H23NO3/c1-8(2)7-10(14)13(5)11(9(3)4)12(15)16-6/h8-9,11H,7H2,1-6H3 |
| InChIKey | AIWKNOBGZBWGCY-UHFFFAOYSA-N |
| Molecular Weight | 229.320 g/mol |
| SMILES | C(CC(N(C(C(C)C)C(OC)=O)C)=O)(C)C |