| SpectraBase Compound ID | ICf1LaZxAFS |
|---|---|
| InChI | InChI=1S/C7H6Cl2N2S/c8-4-1-5(9)3-6(2-4)11-7(10)12/h1-3H,(H3,10,11,12) |
| InChIKey | BNJARXOEVLYKDN-UHFFFAOYSA-N |
| Mol Weight | 221.1 g/mol |
| Molecular Formula | C7H6Cl2N2S |
| Exact Mass | 219.962875 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2tlaZ9Sl4c2 |
|---|---|
| Name | N-(3,5-Dichlorophenyl)thiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 219.962874775 u |
| Formula | C7H6Cl2N2S |
| InChI | InChI=1S/C7H6Cl2N2S/c8-4-1-5(9)3-6(2-4)11-7(10)12/h1-3H,(H3,10,11,12) |
| InChIKey | BNJARXOEVLYKDN-UHFFFAOYSA-N |
| SMILES | N(C=1C=C(C=C(C1)Cl)Cl)C(=S)N |