| SpectraBase Compound ID | 56NKVoh2N4G |
|---|---|
| InChI | InChI=1S/C4H7ClOS/c1-2-3-7-4(5)6/h2-3H2,1H3 |
| InChIKey | FYOPSYJKEHWOBR-UHFFFAOYSA-N |
| Mol Weight | 138.61 g/mol |
| Molecular Formula | C4H7ClOS |
| Exact Mass | 137.990614 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | fc8v0wjbJ1 |
|---|---|
| Name | Carbonochloridothioic acid, S-propyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 137.990613718 u |
| Formula | C4H7ClOS |
| InChI | InChI=1S/C4H7ClOS/c1-2-3-7-4(5)6/h2-3H2,1H3 |
| InChIKey | FYOPSYJKEHWOBR-UHFFFAOYSA-N |
| SMILES | C(Cl)(SCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.846014 |