| SpectraBase Compound ID | 49OFFylN1To |
|---|---|
| InChI | InChI=1S/C11H12N2O2S/c1-7-3-5-9(6-4-7)10(14)13-11(15)12-8(2)16/h3-6H,1-2H3,(H2,12,13,14,15,16) |
| InChIKey | OTYGBQNBKIHLEK-UHFFFAOYSA-N |
| Mol Weight | 236.29 g/mol |
| Molecular Formula | C11H12N2O2S |
| Exact Mass | 236.061949 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ERePC1uEoBB |
|---|---|
| Name | 1-(Thioacetyl)-3-(p-toluoyl)urea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.061948806 u |
| Formula | C11H12N2O2S |
| InChI | InChI=1S/C11H12N2O2S/c1-7-3-5-9(6-4-7)10(14)13-11(15)12-8(2)16/h3-6H,1-2H3,(H2,12,13,14,15,16) |
| InChIKey | OTYGBQNBKIHLEK-UHFFFAOYSA-N |
| Molecular Weight | 236.289 g/mol |
| SMILES | N(C(C1=CC=C(C=C1)C)=O)C(NC(C)=S)=O |