| SpectraBase Compound ID | 99ddkREwHUy |
|---|---|
| InChI | InChI=1S/C16H15ClN2O2S/c17-12-6-2-1-5-11(12)15(20)18-16(21)19-9-3-7-13(19)14-8-4-10-22-14/h1-2,4-6,8,10,13H,3,7,9H2,(H,18,20,21) |
| InChIKey | TWPKRNCYPSPGEX-UHFFFAOYSA-N |
| Mol Weight | 334.82 g/mol |
| Molecular Formula | C16H15ClN2O2S |
| Exact Mass | 334.054277 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | ASyP0HKjoET |
|---|---|
| Name | N-(o-Chlorobenzoyl)-2-(2-thienyl)-1-pyrrolidinecarboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 334.054276603 u |
| Formula | C16H15ClN2O2S |
| InChI | InChI=1S/C16H15ClN2O2S/c17-12-6-2-1-5-11(12)15(20)18-16(21)19-9-3-7-13(19)14-8-4-10-22-14/h1-2,4-6,8,10,13H,3,7,9H2,(H,18,20,21) |
| InChIKey | TWPKRNCYPSPGEX-UHFFFAOYSA-N |
| Molecular Weight | 334.821 g/mol |
| Nominal Mass | 334 u |
| SMILES | N(C(C1=CC=CC=C1Cl)=O)C(N1C(CCC1)C1=CC=CS1)=O |