| SpectraBase Compound ID | IdYGSShn9Ew |
|---|---|
| InChI | InChI=1S/C19H22N2O2S/c1-4-11-23-17-9-6-15(7-10-17)18(22)21-19(24)20-16-8-5-13(2)14(3)12-16/h5-10,12H,4,11H2,1-3H3,(H2,20,21,22,24) |
| InChIKey | GPDDEVFZGUMLDJ-UHFFFAOYSA-N |
| Mol Weight | 342.46 g/mol |
| Molecular Formula | C19H22N2O2S |
| Exact Mass | 342.140199 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LLqnIiPz5cP |
|---|---|
| Name | N-(3,4-Dimethylphenyl)-N'-(4-propoxybenzoyl)thiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.140199128 u |
| Formula | C19H22N2O2S |
| InChI | InChI=1S/C19H22N2O2S/c1-4-11-23-17-9-6-15(7-10-17)18(22)21-19(24)20-16-8-5-13(2)14(3)12-16/h5-10,12H,4,11H2,1-3H3,(H2,20,21,22,24) |
| InChIKey | GPDDEVFZGUMLDJ-UHFFFAOYSA-N |
| SMILES | N(C(NC=1C=C(C)C(=CC1)C)=S)C(C1=CC=C(OCCC)C=C1)=O |