| SpectraBase Compound ID | C7dveW5fFhe |
|---|---|
| InChI | InChI=1S/C7H14S/c1-2-7-5-3-4-6-8-7/h7H,2-6H2,1H3 |
| InChIKey | GYIFZSXJAVPBLL-UHFFFAOYSA-N |
| Mol Weight | 130.25 g/mol |
| Molecular Formula | C7H14S |
| Exact Mass | 130.081622 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EqM8y7t56oW |
|---|---|
| Name | 2-Ethylthiane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 130.081621625 u |
| Formula | C7H14S |
| InChI | InChI=1S/C7H14S/c1-2-7-5-3-4-6-8-7/h7H,2-6H2,1H3 |
| InChIKey | GYIFZSXJAVPBLL-UHFFFAOYSA-N |
| Molecular Weight | 130.249 g/mol |
| SMILES | C1(SCCCC1)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.855651 |