| SpectraBase Compound ID | 5OFIiq7D9lW |
|---|---|
| InChI | InChI=1S/C11H21NO4/c1-5-6-16-11(14)12-9(7-8(2)3)10(13)15-4/h8-9H,5-7H2,1-4H3,(H,12,14) |
| InChIKey | SCKSDYKUZRJKHG-UHFFFAOYSA-N |
| Mol Weight | 231.29 g/mol |
| Molecular Formula | C11H21NO4 |
| Exact Mass | 231.147058 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4DzcQpb5oYy |
|---|---|
| Name | L-Leucine, N-(N-propyloxycarbonyl)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 231.147058156 u |
| Formula | C11H21NO4 |
| InChI | InChI=1S/C11H21NO4/c1-5-6-16-11(14)12-9(7-8(2)3)10(13)15-4/h8-9H,5-7H2,1-4H3,(H,12,14) |
| InChIKey | SCKSDYKUZRJKHG-UHFFFAOYSA-N |
| Molecular Weight | 231.292 g/mol |
| SMILES | C(C(C(OC)=O)NC(OCCC)=O)C(C)C |