| SpectraBase Compound ID | HnKaxnVlVse |
|---|---|
| InChI | InChI=1S/C12H15NO4S/c1-9-4-6-10(7-5-9)18(16,17)13-8-2-3-11(13)12(14)15/h4-7,11H,2-3,8H2,1H3,(H,14,15) |
| InChIKey | CGPHGPCHVUSFFA-UHFFFAOYSA-N |
| Mol Weight | 269.31 g/mol |
| Molecular Formula | C12H15NO4S |
| Exact Mass | 269.072179 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EecFBB7i8i8 |
|---|---|
| Name | N-Tosyl-L-proline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.072179137 u |
| Formula | C12H15NO4S |
| InChI | InChI=1S/C12H15NO4S/c1-9-4-6-10(7-5-9)18(16,17)13-8-2-3-11(13)12(14)15/h4-7,11H,2-3,8H2,1H3,(H,14,15) |
| InChIKey | CGPHGPCHVUSFFA-UHFFFAOYSA-N |
| SMILES | C1N([C@@](CC1)(C(O)=O)[H])S(=O)(=O)C1=CC=C(C)C=C1 |