| SpectraBase Compound ID | GQomLqehNu9 |
|---|---|
| InChI | InChI=1S/C10H11NS/c1-7-6-8-4-2-3-5-9(8)10(12)11-7/h2-5,7H,6H2,1H3,(H,11,12) |
| InChIKey | IIQJIUVGFDXFAC-UHFFFAOYSA-N |
| Mol Weight | 177.26 g/mol |
| Molecular Formula | C10H11NS |
| Exact Mass | 177.061221 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Ie0aj0cKGeF |
|---|---|
| Name | 3-Methyl-3,4-dihydro-2H-isoquinoline-1-thione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 177.061220532 u |
| Formula | C10H11NS |
| InChI | InChI=1S/C10H11NS/c1-7-6-8-4-2-3-5-9(8)10(12)11-7/h2-5,7H,6H2,1H3,(H,11,12) |
| InChIKey | IIQJIUVGFDXFAC-UHFFFAOYSA-N |
| Molecular Weight | 177.265 g/mol |
| SMILES | C1(NC(C)CC2=C1C=CC=C2)=S |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.848504 |