| SpectraBase Compound ID | BOxm8qr1sJx |
|---|---|
| InChI | InChI=1S/C15H15ClN2S2/c16-12-6-8-14(9-7-12)20-11-10-17-15(19)18-13-4-2-1-3-5-13/h1-9H,10-11H2,(H2,17,18,19) |
| InChIKey | OGEPLMZYNGVTLY-UHFFFAOYSA-N |
| Mol Weight | 322.87 g/mol |
| Molecular Formula | C15H15ClN2S2 |
| Exact Mass | 322.036519 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EmQB9VGmcWX |
|---|---|
| Name | 1-(2-(p-Chlorophenylthio)ethyl)-3-phenylthiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.036518539 u |
| Formula | C15H15ClN2S2 |
| InChI | InChI=1S/C15H15ClN2S2/c16-12-6-8-14(9-7-12)20-11-10-17-15(19)18-13-4-2-1-3-5-13/h1-9H,10-11H2,(H2,17,18,19) |
| InChIKey | OGEPLMZYNGVTLY-UHFFFAOYSA-N |
| Molecular Weight | 322.872 g/mol |
| SMILES | C(NC1=CC=CC=C1)(NCCSC1=CC=C(C=C1)Cl)=S |