| SpectraBase Compound ID | E2ofb6HdA73 |
|---|---|
| InChI | InChI=1S/C12H15ClN2S/c13-9-4-3-7-11(8-9)15-12(16)14-10-5-1-2-6-10/h3-4,7-8,10H,1-2,5-6H2,(H2,14,15,16) |
| InChIKey | NTDPBYPQIPASSO-UHFFFAOYSA-N |
| Mol Weight | 254.78 g/mol |
| Molecular Formula | C12H15ClN2S |
| Exact Mass | 254.064447 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CjRoIXDPPjV |
|---|---|
| Name | N-(3-Chlorophenyl)-N'-cyclopentylthiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.064447365 u |
| Formula | C12H15ClN2S |
| InChI | InChI=1S/C12H15ClN2S/c13-9-4-3-7-11(8-9)15-12(16)14-10-5-1-2-6-10/h3-4,7-8,10H,1-2,5-6H2,(H2,14,15,16) |
| InChIKey | NTDPBYPQIPASSO-UHFFFAOYSA-N |
| SMILES | N(C(NC1CCCC1)=S)C1=CC(Cl)=CC=C1 |