| SpectraBase Compound ID | CsKjy7Lg3oj |
|---|---|
| InChI | InChI=1S/C6H12S/c1-6-3-2-4-7-5-6/h6H,2-5H2,1H3 |
| InChIKey | WTPRCAYZVQKROM-UHFFFAOYSA-N |
| Mol Weight | 116.22 g/mol |
| Molecular Formula | C6H12S |
| Exact Mass | 116.065972 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HJjj6LeXf6I |
|---|---|
| Name | 3-METHYLTHIAN |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C6H12S |
| InChI | InChI=1S/C6H12S/c1-6-3-2-4-7-5-6/h6H,2-5H2,1H3 |
| InChIKey | WTPRCAYZVQKROM-UHFFFAOYSA-N |
| Literature Reference Author | R.L.WILLER,E.L.ELIEL |
| Literature Reference Citation | J.AM.CHEM.SOC.,99,1925(1977) |
| Literature Reference DOI | 10.1021/ja00448a039 |
| Molecular Weight | 116.221 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW9073 |