| SpectraBase Compound ID | CQXIscEQlyx |
|---|---|
| InChI | InChI=1S/C11H19NO4/c1-5-6-15-11(14)12-9(4)10(13)16-7-8(2)3/h5,8-9H,1,6-7H2,2-4H3,(H,12,14) |
| InChIKey | QYQZWMMDUTWMAJ-UHFFFAOYSA-N |
| Mol Weight | 229.28 g/mol |
| Molecular Formula | C11H19NO4 |
| Exact Mass | 229.131408 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7Qnfurc03bM |
|---|---|
| Name | L-Alanine, N-allyloxycarbonyl-, isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 229.131408092 u |
| Formula | C11H19NO4 |
| InChI | InChI=1S/C11H19NO4/c1-5-6-15-11(14)12-9(4)10(13)16-7-8(2)3/h5,8-9H,1,6-7H2,2-4H3,(H,12,14) |
| InChIKey | QYQZWMMDUTWMAJ-UHFFFAOYSA-N |
| Molecular Weight | 229.276 g/mol |
| SMILES | C=CCOC(NC(C(OCC(C)C)=O)C)=O |