| SpectraBase Compound ID | LvjRup7hxq1 |
|---|---|
| InChI | InChI=1S/C13H21NO4S/c1-5-7-17-13(16)14-11(6-8-19-4)12(15)18-9-10(2)3/h1,10-11H,6-9H2,2-4H3,(H,14,16) |
| InChIKey | PUHMFKZIOVMZKW-UHFFFAOYSA-N |
| Mol Weight | 287.37 g/mol |
| Molecular Formula | C13H21NO4S |
| Exact Mass | 287.119129 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5lGddHYl0Kb |
|---|---|
| Name | L-Methionine, N-propargyloxycarbonyl-, isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.119129330 u |
| Formula | C13H21NO4S |
| InChI | InChI=1S/C13H21NO4S/c1-5-7-17-13(16)14-11(6-8-19-4)12(15)18-9-10(2)3/h1,10-11H,6-9H2,2-4H3,(H,14,16) |
| InChIKey | PUHMFKZIOVMZKW-UHFFFAOYSA-N |
| SMILES | C#CCOC(NC(C(OCC(C)C)=O)CCSC)=O |