![3,6-DIOXA-9-THIATETRACYCLO[6.1.0.02,4.05,7]NONANE](/api/spectrum/4hcHT2yr2Yy/structure.png?h=300&w=458 "3,6-DIOXA-9-THIATETRACYCLO[6.1.0.02,4.05,7]NONANE")
| SpectraBase Compound ID | 7cyBea52UoV |
|---|---|
| InChI | InChI=1S/C6H6O2S/c7-1-2-4(8-2)6-5(9-6)3(1)7/h1-6H |
| InChIKey | KHJHBBIWIOEPNW-UHFFFAOYSA-N |
| Mol Weight | 142.17 g/mol |
| Molecular Formula | C6H6O2S |
| Exact Mass | 142.008851 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4hcHT2yr2Yy |
|---|---|
| Name | .alpha.,.alpha.-Dioxa.beta.-thia-tris.sigma.-homobenzene |
| CAS Registry Number | 54308-05-3 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C6H6O2S |
| InChI | InChI=1S/C6H6O2S/c7-1-2-4(8-2)6-5(9-6)3(1)7/h1-6H |
| InChIKey | KHJHBBIWIOEPNW-UHFFFAOYSA-N |
| Literature Reference | H. Prinzbach, C. Kaiser, Angew. Chem. 87, 249 (1975). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |