| SpectraBase Compound ID | 6DI9cjKIFqS |
|---|---|
| InChI | InChI=1S/C10H19BrS4/c11-10-8-14-6-4-12-2-1-3-13-5-7-15-9-10/h10H,1-9H2 |
| InChIKey | FPYFOVFLPRLPHD-UHFFFAOYSA-N |
| Mol Weight | 347.4 g/mol |
| Molecular Formula | C10H19BrS4 |
| Exact Mass | 345.955298 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IqFr9XJRPDx |
|---|---|
| Name | 6-Bromo-1,4,8,11-tetrathiacyclotetradecane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 345.955298308 u |
| Formula | C10H19BrS4 |
| InChI | InChI=1S/C10H19BrS4/c11-10-8-14-6-4-12-2-1-3-13-5-7-15-9-10/h10H,1-9H2 |
| InChIKey | FPYFOVFLPRLPHD-UHFFFAOYSA-N |
| Molecular Weight | 347.406 g/mol |
| SMILES | C1CSCCCSCCSCC(CS1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.958513 |