| SpectraBase Compound ID | FibdfzNNJjW |
|---|---|
| InChI | InChI=1S/C8H8OS2/c1-10-8(9)11-7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey | MSXKMQPVMYECGD-UHFFFAOYSA-N |
| Mol Weight | 184.27 g/mol |
| Molecular Formula | C8H8OS2 |
| Exact Mass | 184.001657 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DjR3g4kQPSw |
|---|---|
| Name | Carbonic acid, dithio-, S-methyl S-phenyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.001657225 u |
| Formula | C8H8OS2 |
| InChI | InChI=1S/C8H8OS2/c1-10-8(9)11-7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey | MSXKMQPVMYECGD-UHFFFAOYSA-N |
| SMILES | C(SC1=CC=CC=C1)(SC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.881102 |