| SpectraBase Compound ID | AZjuO3kQ2xO |
|---|---|
| InChI | InChI=1S/C13H9Cl3N2S/c14-8-3-1-4-9(7-8)17-13(19)18-12-10(15)5-2-6-11(12)16/h1-7H,(H2,17,18,19) |
| InChIKey | FCEHFRSVGKBPTG-UHFFFAOYSA-N |
| Mol Weight | 331.65 g/mol |
| Molecular Formula | C13H9Cl3N2S |
| Exact Mass | 329.955203 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Ua8HUfQkyL |
|---|---|
| Name | 1-(3-Chlorophenyl)-3-(2,6-dichlorophenyl)thiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 329.955202572 u |
| Formula | C13H9Cl3N2S |
| InChI | InChI=1S/C13H9Cl3N2S/c14-8-3-1-4-9(7-8)17-13(19)18-12-10(15)5-2-6-11(12)16/h1-7H,(H2,17,18,19) |
| InChIKey | FCEHFRSVGKBPTG-UHFFFAOYSA-N |
| Molecular Weight | 331.648 g/mol |
| SMILES | C(NC1=C(Cl)C=CC=C1Cl)(NC1=CC(Cl)=CC=C1)=S |