| SpectraBase Compound ID | CeTv26FUciQ |
|---|---|
| InChI | InChI=1S/C13H17ClN2S/c14-10-5-4-8-12(9-10)16-13(17)15-11-6-2-1-3-7-11/h4-5,8-9,11H,1-3,6-7H2,(H2,15,16,17) |
| InChIKey | DDSOXQVCKMHZQL-UHFFFAOYSA-N |
| Mol Weight | 268.81 g/mol |
| Molecular Formula | C13H17ClN2S |
| Exact Mass | 268.080097 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JnWDKhFVc89 |
|---|---|
| Name | N-(3-Chlorophenyl)-N'-cyclohexylthiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.080097429 u |
| Formula | C13H17ClN2S |
| InChI | InChI=1S/C13H17ClN2S/c14-10-5-4-8-12(9-10)16-13(17)15-11-6-2-1-3-7-11/h4-5,8-9,11H,1-3,6-7H2,(H2,15,16,17) |
| InChIKey | DDSOXQVCKMHZQL-UHFFFAOYSA-N |
| SMILES | N(C(=S)NC=1C=CC=C(C1)Cl)C1CCCCC1 |