| SpectraBase Compound ID | KB0yILdA9Mg |
|---|---|
| InChI | InChI=1S/C5H8OS/c1-3-5(6)4(2)7-3/h3-4H,1-2H3 |
| InChIKey | RMZOERUZYCSGRZ-UHFFFAOYSA-N |
| Mol Weight | 116.18 g/mol |
| Molecular Formula | C5H8OS |
| Exact Mass | 116.029586 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KUUn1K4I0OO |
|---|---|
| Name | trans-2,4-DIMETHYL-3-THIETANONE |
| Source of Sample | B. Foehlisch, W. Gottstein Liebigs Ann. Chem. 1979, 1768 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H8OS |
| InChI | InChI=1S/C5H8OS/c1-3-5(6)4(2)7-3/h3-4H,1-2H3 |
| InChIKey | RMZOERUZYCSGRZ-UHFFFAOYSA-N |
| Molecular Weight | 116.18 |
| Solvent | Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker HX-90 |
| Synonyms | 3-THIETANONE, 2,4-DIMETHYL-, trans-, |