| SpectraBase Compound ID | 4vZdS1mqHHm |
|---|---|
| InChI | InChI=1S/C6H7NS/c1-7-5-3-2-4-6(7)8/h2-5H,1H3 |
| InChIKey | UHOAUPKGWPQNDM-UHFFFAOYSA-N |
| Mol Weight | 125.19 g/mol |
| Molecular Formula | C6H7NS |
| Exact Mass | 125.02992 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | B7XbBNvuhot |
|---|---|
| Name | 1-Methyl-2(1H)-pyridinethione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 125.029920403 u |
| Formula | C6H7NS |
| InChI | InChI=1S/C6H7NS/c1-7-5-3-2-4-6(7)8/h2-5H,1H3 |
| InChIKey | UHOAUPKGWPQNDM-UHFFFAOYSA-N |
| Molecular Weight | 125.189 g/mol |
| SMILES | C=1C(N(C=CC1)C)=S |
| Spectrum/Structure Validation Score (Raman) | 0.701252 |