| SpectraBase Compound ID | DQ9YSCMphHX |
|---|---|
| InChI | InChI=1S/C11H12O3S/c1-9(10(2)12)8-15(13,14)11-6-4-3-5-7-11/h3-8H,1-2H3/b9-8+ |
| InChIKey | USEXONBUPHCPQG-CMDGGOBGSA-N |
| Mol Weight | 224.27 g/mol |
| Molecular Formula | C11H12O3S |
| Exact Mass | 224.050715 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G15dTjBAa0 |
|---|---|
| Name | (E)-3-METHYL-4-SULFONYL-BUT-3-EN-2-ONE |
| Compound Number | 18 |
| Copyright | Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C11H12O3S/c1-9(10(2)12)8-15(13,14)11-6-4-3-5-7-11/h3-8H,1-2H3/b9-8+ |
| InChIKey | USEXONBUPHCPQG-CMDGGOBGSA-N |
| Literature Reference | S.KOUL,D.H.G.CROUT,W.ERRINGTON,J.TAX J.CHEM.SOC.PERKIN-1,2969(1995) |
| Solvent | Chloroform-d |