| SpectraBase Compound ID | CqDVX631H3M |
|---|---|
| InChI | InChI=1S/C6H12N2S2/c1-3-9-5(7-1)6-8-2-4-10-6/h5-8H,1-4H2 |
| InChIKey | BALPQDWQADEPOU-UHFFFAOYSA-N |
| Mol Weight | 176.3 g/mol |
| Molecular Formula | C6H12N2S2 |
| Exact Mass | 176.044191 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Bkn5eu5yfiP |
|---|---|
| Name | 2,2'-Bithiazolidine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.044190742 u |
| Formula | C6H12N2S2 |
| InChI | InChI=1S/C6H12N2S2/c1-3-9-5(7-1)6-8-2-4-10-6/h5-8H,1-4H2 |
| InChIKey | BALPQDWQADEPOU-UHFFFAOYSA-N |
| SMILES | C1NC(SC1)C1SCCN1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.832349 |