![9-Thiabicyclo[3.3.1]nonan-3-one](/api/spectrum/43OLeSlAw1D/structure.png?h=300&w=458 "9-Thiabicyclo[3.3.1]nonan-3-one")
| SpectraBase Compound ID | aJEhBsbFuo |
|---|---|
| InChI | InChI=1S/C8H12OS/c9-6-4-7-2-1-3-8(5-6)10-7/h7-8H,1-5H2 |
| InChIKey | RCONYUCQGTXZGJ-UHFFFAOYSA-N |
| Mol Weight | 156.24 g/mol |
| Molecular Formula | C8H12OS |
| Exact Mass | 156.060886 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 43OLeSlAw1D |
|---|---|
| Name | 9-Thiabicyclo[3.3.1]nonan-3-one |
| CAS Registry Number | 67194-70-1 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H12OS |
| InChI | InChI=1S/C8H12OS/c9-6-4-7-2-1-3-8(5-6)10-7/h7-8H,1-5H2/t7-,8+ |
| InChIKey | RCONYUCQGTXZGJ-UHFFFAOYSA-N |
| Molecular Weight | 156.243 g/mol |
| SMILES | C1(=O)C[C@]2(S[C@@](C1)(CCC2)[H])[H] |
| SPLASH | splash10-0nmu-9400000000-1ddd78434e2022f0ca5b |
| Source of Spectrum | J-43-3809-0 |
| Wiley ID | 1153349 |