| SpectraBase Compound ID | K3hWmMLpugP |
|---|---|
| InChI | InChI=1S/C11H15ClN2O2S/c1-15-10(16-2)7-13-11(17)14-9-5-3-4-8(12)6-9/h3-6,10H,7H2,1-2H3,(H2,13,14,17) |
| InChIKey | ZQWURQPEAJNLTD-UHFFFAOYSA-N |
| Mol Weight | 274.77 g/mol |
| Molecular Formula | C11H15ClN2O2S |
| Exact Mass | 274.054277 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | in8neNMOaU |
|---|---|
| Name | N-(3-Chlorophenyl)-N'-(2,2-dimethoxyethyl)thiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.054276603 u |
| Formula | C11H15ClN2O2S |
| InChI | InChI=1S/C11H15ClN2O2S/c1-15-10(16-2)7-13-11(17)14-9-5-3-4-8(12)6-9/h3-6,10H,7H2,1-2H3,(H2,13,14,17) |
| InChIKey | ZQWURQPEAJNLTD-UHFFFAOYSA-N |
| Molecular Weight | 274.766 g/mol |
| SMILES | N(C(=S)NCC(OC)OC)C1=CC(Cl)=CC=C1 |