![N-[2-[p-Chloeophenylthio]ethyl]-4-hydroxybutyramide](/api/spectrum/IMgPiAI8Fcj/structure.png?h=300&w=458 "N-[2-[p-Chloeophenylthio]ethyl]-4-hydroxybutyramide")
| SpectraBase Compound ID | FsjnPRXiHfd |
|---|---|
| InChI | InChI=1S/C12H16ClNO2S/c13-10-3-5-11(6-4-10)17-9-7-14-12(16)2-1-8-15/h3-6,15H,1-2,7-9H2,(H,14,16) |
| InChIKey | HJBMBHBPYBAMMD-UHFFFAOYSA-N |
| Mol Weight | 273.78 g/mol |
| Molecular Formula | C12H16ClNO2S |
| Exact Mass | 273.059028 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IMgPiAI8Fcj |
|---|---|
| Name | N-[2-[p-Chloeophenylthio]ethyl]-4-hydroxybutyramide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.059027631 u |
| Formula | C12H16ClNO2S |
| InChI | InChI=1S/C12H16ClNO2S/c13-10-3-5-11(6-4-10)17-9-7-14-12(16)2-1-8-15/h3-6,15H,1-2,7-9H2,(H,14,16) |
| InChIKey | HJBMBHBPYBAMMD-UHFFFAOYSA-N |
| Molecular Weight | 273.778 g/mol |
| SMILES | C(O)CCC(=O)NCCSC=1C=CC(Cl)=CC1 |