| SpectraBase Compound ID | 85S1Klz646W |
|---|---|
| InChI | InChI=1S/C9H12OS2/c1-2-3-5-8(10)9-11-6-4-7-12-9/h9H,2,4,6-7H2,1H3 |
| InChIKey | KRWIZVBHCKORNT-UHFFFAOYSA-N |
| Mol Weight | 200.31 g/mol |
| Molecular Formula | C9H12OS2 |
| Exact Mass | 200.032957 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HPYnG7bOdfO |
|---|---|
| Name | 1-(1,3-Dithian-2-yl)pent-2-yn-1-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H12OS2 |
| InChI | InChI=1S/C9H12OS2/c1-2-3-5-8(10)9-11-6-4-7-12-9/h9H,2,4,6-7H2,1H3 |
| InChIKey | KRWIZVBHCKORNT-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/acs.joc.5b02350 |
| Molecular Weight | 200.314 g/mol |
| SMILES | C(C#CCC)(=O)C1SCCCS1 |
| SPLASH | splash10-014i-4900000000-c2f878cf892e2d147d91 |
| Source of Spectrum | J-81-1398-28 |
| Wiley ID | 1804316 |