| SpectraBase Compound ID | GyqOLtLepbu |
|---|---|
| InChI | InChI=1S/C3H6S5/c1-2-5-8-7-3-6-4-1/h1-3H2 |
| InChIKey | QDBXJAGHXXYTLP-UHFFFAOYSA-N |
| Mol Weight | 202.4 g/mol |
| Molecular Formula | C3H6S5 |
| Exact Mass | 201.907306 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4vh4acVcc88 |
|---|---|
| Name | 1,3,4,5,8-Pentathiacyclooctane |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C3H6S5 |
| InChI | InChI=1S/C3H6S5/c1-2-5-8-7-3-6-4-1/h1-3H2 |
| InChIKey | QDBXJAGHXXYTLP-UHFFFAOYSA-N |
| Molecular Weight | 202.381 g/mol |
| SMILES | C1SSSCCSS1 |
| SPLASH | splash10-0002-9010000000-3ef10d09697626f57fda |
| Source of Spectrum | K-130-762-18 |
| Synonyms | 1,2,3,5,6-Pentathiocane |
| Wiley ID | 1199068 |