| SpectraBase Compound ID | 48ZOlFA2uJ3 |
|---|---|
| InChI | InChI=1S/C18H19NO3S/c1-15-7-9-17(10-8-15)23(21,22)14-12-18(20)19-13-11-16-5-3-2-4-6-16/h2-10,12,14H,11,13H2,1H3,(H,19,20)/b14-12+ |
| InChIKey | IPFOGMVRFWCDOH-WYMLVPIESA-N |
| Mol Weight | 329.41 g/mol |
| Molecular Formula | C18H19NO3S |
| Exact Mass | 329.108565 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EgtHHyzm16J |
|---|---|
| Name | (E)-N-Phenethyl-3-tosyl-acrylamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 329.108564647 u |
| Formula | C18H19NO3S |
| InChI | InChI=1S/C18H19NO3S/c1-15-7-9-17(10-8-15)23(21,22)14-12-18(20)19-13-11-16-5-3-2-4-6-16/h2-10,12,14H,11,13H2,1H3,(H,19,20)/b14-12+ |
| InChIKey | IPFOGMVRFWCDOH-WYMLVPIESA-N |
| Molecular Weight | 329.414 g/mol |
| SMILES | C(\C=C\S(C=1C=CC(=CC1)C)(=O)=O)(=O)NCCC=1C=CC=CC1 |