| SpectraBase Compound ID | HgFBIeKl8uc |
|---|---|
| InChI | InChI=1S/C13H19NO4S/c1-4-12(13(15)18-5-2)14-19(16,17)11-8-6-10(3)7-9-11/h6-9,12,14H,4-5H2,1-3H3 |
| InChIKey | RAYCRIUYWCBSKN-UHFFFAOYSA-N |
| Mol Weight | 285.36 g/mol |
| Molecular Formula | C13H19NO4S |
| Exact Mass | 285.103479 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3KRsgvm15G3 |
|---|---|
| Name | 2-(Tosylamino)butyric acid ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.103479266 u |
| Formula | C13H19NO4S |
| InChI | InChI=1S/C13H19NO4S/c1-4-12(13(15)18-5-2)14-19(16,17)11-8-6-10(3)7-9-11/h6-9,12,14H,4-5H2,1-3H3 |
| InChIKey | RAYCRIUYWCBSKN-UHFFFAOYSA-N |
| SMILES | C(NS(C=1C=CC(=CC1)C)(=O)=O)(C(=O)OCC)CC |