| SpectraBase Compound ID | 39VGT26ko7i |
|---|---|
| InChI | InChI=1S/C13H18Cl2N2O2S/c1-3-18-12(19-4-2)8-16-13(20)17-11-6-5-9(14)7-10(11)15/h5-7,12H,3-4,8H2,1-2H3,(H2,16,17,20) |
| InChIKey | VMRPGWCWYCJMLU-UHFFFAOYSA-N |
| Mol Weight | 337.27 g/mol |
| Molecular Formula | C13H18Cl2N2O2S |
| Exact Mass | 336.046604 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LqmFd3DNiUu |
|---|---|
| Name | 1-(2,4-Dichlorophenyl)-3-(2,2-diethoxyethyl)-2-thiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.046604400 u |
| Formula | C13H18Cl2N2O2S |
| InChI | InChI=1S/C13H18Cl2N2O2S/c1-3-18-12(19-4-2)8-16-13(20)17-11-6-5-9(14)7-10(11)15/h5-7,12H,3-4,8H2,1-2H3,(H2,16,17,20) |
| InChIKey | VMRPGWCWYCJMLU-UHFFFAOYSA-N |
| Molecular Weight | 337.265 g/mol |
| SMILES | N(C1=CC=C(C=C1Cl)Cl)C(NCC(OCC)OCC)=S |