| SpectraBase Compound ID | DUIjco6QoHf |
|---|---|
| InChI | InChI=1S/C11H11NS/c1-2-8-7-11(13)9-5-3-4-6-10(9)12-8/h3-7H,2H2,1H3,(H,12,13) |
| InChIKey | YXLHBKGWWZPLMC-UHFFFAOYSA-N |
| Mol Weight | 189.28 g/mol |
| Molecular Formula | C11H11NS |
| Exact Mass | 189.061221 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Ghs3samQ55B |
|---|---|
| Name | 2-Ethylquinoline-4(1H)-thione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.061220532 u |
| Formula | C11H11NS |
| InChI | InChI=1S/C11H11NS/c1-2-8-7-11(13)9-5-3-4-6-10(9)12-8/h3-7H,2H2,1H3,(H,12,13) |
| InChIKey | YXLHBKGWWZPLMC-UHFFFAOYSA-N |
| Molecular Weight | 189.276 g/mol |
| SMILES | C1(C=C(CC)NC2=C1C=CC=C2)=S |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.862407 |