| SpectraBase Compound ID | Gn6A8qiyrwz |
|---|---|
| InChI | InChI=1S/C13H23NO4S/c1-4-6-9-17-12(15)11(7-10-19-3)14-13(16)18-8-5-2/h5,11H,2,4,6-10H2,1,3H3,(H,14,16) |
| InChIKey | ABBKVKLXQXUSKP-UHFFFAOYSA-N |
| Mol Weight | 289.39 g/mol |
| Molecular Formula | C13H23NO4S |
| Exact Mass | 289.134779 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KxdKMvTdGZ9 |
|---|---|
| Name | L-Methionine, N-allyloxycarbonyl-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.134779395 u |
| Formula | C13H23NO4S |
| InChI | InChI=1S/C13H23NO4S/c1-4-6-9-17-12(15)11(7-10-19-3)14-13(16)18-8-5-2/h5,11H,2,4,6-10H2,1,3H3,(H,14,16) |
| InChIKey | ABBKVKLXQXUSKP-UHFFFAOYSA-N |
| SMILES | C=CCOC(NC(C(OCCCC)=O)CCSC)=O |