![Propanamide, N-(4-ethenylphenyl)-3-[(2-hydroxyethyl)thio]-](/api/spectrum/9oE2xewnkwR/structure.png?h=300&w=458 "Propanamide, N-(4-ethenylphenyl)-3-[(2-hydroxyethyl)thio]-")
| SpectraBase Compound ID | Dfyx8vVQze6 |
|---|---|
| InChI | InChI=1S/C13H17NO2S/c1-2-11-3-5-12(6-4-11)14-13(16)7-9-17-10-8-15/h2-6,15H,1,7-10H2,(H,14,16) |
| InChIKey | HERVEMNESYAUGB-UHFFFAOYSA-N |
| Mol Weight | 251.34 g/mol |
| Molecular Formula | C13H17NO2S |
| Exact Mass | 251.098 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9oE2xewnkwR |
|---|---|
| Name | Propanamide, N-(4-ethenylphenyl)-3-[(2-hydroxyethyl)thio]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.097999963 u |
| Formula | C13H17NO2S |
| InChI | InChI=1S/C13H17NO2S/c1-2-11-3-5-12(6-4-11)14-13(16)7-9-17-10-8-15/h2-6,15H,1,7-10H2,(H,14,16) |
| InChIKey | HERVEMNESYAUGB-UHFFFAOYSA-N |
| Molecular Weight | 251.344 g/mol |
| SMILES | C(O)CSCCC(=O)NC1=CC=C(C=C1)C=C |