| SpectraBase Compound ID | 7qPLDBpxQcI |
|---|---|
| InChI | InChI=1S/C13H10Cl2N2S/c14-9-4-6-11(7-5-9)16-13(18)17-12-3-1-2-10(15)8-12/h1-8H,(H2,16,17,18) |
| InChIKey | GRYROFYHQBVWKJ-UHFFFAOYSA-N |
| Mol Weight | 297.2 g/mol |
| Molecular Formula | C13H10Cl2N2S |
| Exact Mass | 295.994175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AzBdca9JOAa |
|---|---|
| Name | 1-(3-Chlorophenyl)-3-(4-chlorophenyl)thiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.994174904 u |
| Formula | C13H10Cl2N2S |
| InChI | InChI=1S/C13H10Cl2N2S/c14-9-4-6-11(7-5-9)16-13(18)17-12-3-1-2-10(15)8-12/h1-8H,(H2,16,17,18) |
| InChIKey | GRYROFYHQBVWKJ-UHFFFAOYSA-N |
| Molecular Weight | 297.203 g/mol |
| SMILES | C(NC1=CC(Cl)=CC=C1)(NC=1C=CC(=CC1)Cl)=S |