| SpectraBase Compound ID | 4OCk2G1aZIW |
|---|---|
| InChI | InChI=1S/C13H14N2OS2/c1-16-11-6-4-10(5-7-11)15-13(17)14-9-12-3-2-8-18-12/h2-8H,9H2,1H3,(H2,14,15,17) |
| InChIKey | UOJOTAZXNLWDSC-UHFFFAOYSA-N |
| Mol Weight | 278.39 g/mol |
| Molecular Formula | C13H14N2OS2 |
| Exact Mass | 278.054755 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8gnQANqQxQ0 |
|---|---|
| Name | N-(4-Methoxyphenyl)-N'-(2-thienylmethyl)thiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.054755426 u |
| Formula | C13H14N2OS2 |
| InChI | InChI=1S/C13H14N2OS2/c1-16-11-6-4-10(5-7-11)15-13(17)14-9-12-3-2-8-18-12/h2-8H,9H2,1H3,(H2,14,15,17) |
| InChIKey | UOJOTAZXNLWDSC-UHFFFAOYSA-N |
| Molecular Weight | 278.388 g/mol |
| SMILES | N(C(=S)NCC=1SC=CC1)C1=CC=C(C=C1)OC |