| SpectraBase Compound ID | IErdBorX7i6 |
|---|---|
| InChI | InChI=1S/C6H6OS/c1-5-2-3-8-6(7)4-5/h2-4H,1H3 |
| InChIKey | GSOKJJZRCROYHT-UHFFFAOYSA-N |
| Mol Weight | 126.17 g/mol |
| Molecular Formula | C6H6OS |
| Exact Mass | 126.013936 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6vvIHqyMnVL |
|---|---|
| Name | 4-METHYLTHIAPYRAN-2-ONE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C6H6OS |
| InChI | InChI=1S/C6H6OS/c1-5-2-3-8-6(7)4-5/h2-4H,1H3 |
| InChIKey | GSOKJJZRCROYHT-UHFFFAOYSA-N |
| Literature Reference Author | W.V.TURNER,W.H.PIRKLE |
| Literature Reference Citation | J.ORG.CHEM.,39,1935(1974) |
| Literature Reference DOI | 10.1021/jo00927a030 |
| Molecular Weight | 126.173 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW11273 |