| SpectraBase Compound ID | 64pWapJx9dh |
|---|---|
| InChI | InChI=1S/C7H8N2OS/c1-11-7(10)9-6-4-2-3-5-8-6/h2-5H,1H3,(H,8,9,10) |
| InChIKey | JWKKLSBLXXWTMB-UHFFFAOYSA-N |
| Mol Weight | 168.21 g/mol |
| Molecular Formula | C7H8N2OS |
| Exact Mass | 168.035734 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LsYL4Wv8NYK |
|---|---|
| Name | S-Methyl N-(pyrid-2-yl)thiocarbamate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.035734059 u |
| Formula | C7H8N2OS |
| InChI | InChI=1S/C7H8N2OS/c1-11-7(10)9-6-4-2-3-5-8-6/h2-5H,1H3,(H,8,9,10) |
| InChIKey | JWKKLSBLXXWTMB-UHFFFAOYSA-N |
| SMILES | C(NC=1C=CC=CN1)(=O)SC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.935429 |