| SpectraBase Compound ID | FQID4IRIkSV |
|---|---|
| InChI | InChI=1S/C16H17ClN2S/c17-15-9-5-4-8-14(15)12-19-16(20)18-11-10-13-6-2-1-3-7-13/h1-9H,10-12H2,(H2,18,19,20) |
| InChIKey | GIUCIXIKCLJEDM-UHFFFAOYSA-N |
| Mol Weight | 304.84 g/mol |
| Molecular Formula | C16H17ClN2S |
| Exact Mass | 304.080097 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6rDMRqRowyr |
|---|---|
| Name | N-(2-Chlorobenzyl)-N'-(2-phenylethyl)thiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.080097429 u |
| Formula | C16H17ClN2S |
| InChI | InChI=1S/C16H17ClN2S/c17-15-9-5-4-8-14(15)12-19-16(20)18-11-10-13-6-2-1-3-7-13/h1-9H,10-12H2,(H2,18,19,20) |
| InChIKey | GIUCIXIKCLJEDM-UHFFFAOYSA-N |
| SMILES | N(CC1=C(Cl)C=CC=C1)C(=S)NCCC1=CC=CC=C1 |