| SpectraBase Compound ID | IeZhVTYqFbf |
|---|---|
| InChI | InChI=1S/C13H25NO4/c1-7-17-12(16)14-10(13(4,5)6)11(15)18-8-9(2)3/h9-10H,7-8H2,1-6H3,(H,14,16) |
| InChIKey | BEPRNWGVYSZZRB-UHFFFAOYSA-N |
| Mol Weight | 259.35 g/mol |
| Molecular Formula | C13H25NO4 |
| Exact Mass | 259.178358 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3VTaiSO3JcP |
|---|---|
| Name | Tert-leucine, N-ethoxycarbonyl-, isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 259.178358285 u |
| Formula | C13H25NO4 |
| InChI | InChI=1S/C13H25NO4/c1-7-17-12(16)14-10(13(4,5)6)11(15)18-8-9(2)3/h9-10H,7-8H2,1-6H3,(H,14,16) |
| InChIKey | BEPRNWGVYSZZRB-UHFFFAOYSA-N |
| Molecular Weight | 259.346 g/mol |
| SMILES | CC(C)COC(C(NC(OCC)=O)C(C)(C)C)=O |