| SpectraBase Compound ID | FldUvev5FAD |
|---|---|
| InChI | InChI=1S/C10H14N2S/c1-6-4-7(2)9(8(3)5-6)12-10(11)13/h4-5H,1-3H3,(H3,11,12,13) |
| InChIKey | LBUGQLLKHAHCJJ-UHFFFAOYSA-N |
| Mol Weight | 194.3 g/mol |
| Molecular Formula | C10H14N2S |
| Exact Mass | 194.08777 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Kw5h7F65MRS |
|---|---|
| Name | 1-Mesityl-2-thiourea |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.087769633 u |
| Formula | C10H14N2S |
| InChI | InChI=1S/C10H14N2S/c1-6-4-7(2)9(8(3)5-6)12-10(11)13/h4-5H,1-3H3,(H3,11,12,13) |
| InChIKey | LBUGQLLKHAHCJJ-UHFFFAOYSA-N |
| SMILES | N(C1=C(C=C(C=C1C)C)C)C(N)=S |
| Spectrum/Structure Validation Score (Raman) | 0.988934 |