| SpectraBase Compound ID | E808uNq9Bi7 |
|---|---|
| InChI | InChI=1S/C6H10N2S/c1-4-5(2)8(3)6(9)7-4/h1-3H3,(H,7,9) |
| InChIKey | PERWAYOEWJEJNO-UHFFFAOYSA-N |
| Mol Weight | 142.22 g/mol |
| Molecular Formula | C6H10N2S |
| Exact Mass | 142.05647 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | L8NKcHNWAcy |
|---|---|
| Name | 1,4,5-Trimethylimidazole-2(3H)-thione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.056469504 u |
| Formula | C6H10N2S |
| InChI | InChI=1S/C6H10N2S/c1-4-5(2)8(3)6(9)7-4/h1-3H3,(H,7,9) |
| InChIKey | PERWAYOEWJEJNO-UHFFFAOYSA-N |
| Molecular Weight | 142.220 g/mol |
| SMILES | C1(NC(=C(N1C)C)C)=S |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.940365 |