| SpectraBase Compound ID | 6b07Rj32Uix |
|---|---|
| InChI | InChI=1S/C12H23NO4S/c1-4-6-8-17-11(14)10(7-9-18-3)13-12(15)16-5-2/h10H,4-9H2,1-3H3,(H,13,15) |
| InChIKey | BSKLFEGBQODYAB-UHFFFAOYSA-N |
| Mol Weight | 277.38 g/mol |
| Molecular Formula | C12H23NO4S |
| Exact Mass | 277.134779 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AiwEaDwYLal |
|---|---|
| Name | L-Methionine, N-ethoxycarbonyl-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.134779395 u |
| Formula | C12H23NO4S |
| InChI | InChI=1S/C12H23NO4S/c1-4-6-8-17-11(14)10(7-9-18-3)13-12(15)16-5-2/h10H,4-9H2,1-3H3,(H,13,15) |
| InChIKey | BSKLFEGBQODYAB-UHFFFAOYSA-N |
| Molecular Weight | 277.379 g/mol |
| SMILES | CCOC(NC(C(OCCCC)=O)CCSC)=O |