| SpectraBase Compound ID | I8xp4nEVYeE |
|---|---|
| InChI | InChI=1S/C11H13ClN2S/c12-9-4-3-5-10(8-9)13-11(15)14-6-1-2-7-14/h3-5,8H,1-2,6-7H2,(H,13,15) |
| InChIKey | GRHXCWILSNENTE-UHFFFAOYSA-N |
| Mol Weight | 240.75 g/mol |
| Molecular Formula | C11H13ClN2S |
| Exact Mass | 240.048797 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JuZgxlEioqY |
|---|---|
| Name | N-(3-Chlorophenyl)-1-pyrrolidinecarbothioamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.048797301 u |
| Formula | C11H13ClN2S |
| InChI | InChI=1S/C11H13ClN2S/c12-9-4-3-5-10(8-9)13-11(15)14-6-1-2-7-14/h3-5,8H,1-2,6-7H2,(H,13,15) |
| InChIKey | GRHXCWILSNENTE-UHFFFAOYSA-N |
| Molecular Weight | 240.752 g/mol |
| SMILES | N(C(N1CCCC1)=S)C=1C=C(Cl)C=CC1 |