| SpectraBase Compound ID | 78hdaHTHIbR |
|---|---|
| InChI | InChI=1S/C11H12O3S/c1-11(2)7-15(13,14)9-6-4-3-5-8(9)10(11)12/h3-6H,7H2,1-2H3 |
| InChIKey | ZYONQECUZKCGKF-UHFFFAOYSA-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 | FWatN3noWoy |
|---|---|
| Name | 3,3-DIMETHYLTHIOCHROMAN-4-ONE, 1,1-DIOXIDE |
| Source of Sample | M. S. Chauhan, I. W. Still Can. J. Chem. 53, 2880(1975) |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H12O3S |
| InChI | InChI=1S/C11H12O3S/c1-11(2)7-15(13,14)9-6-4-3-5-8(9)10(11)12/h3-6H,7H2,1-2H3 |
| InChIKey | ZYONQECUZKCGKF-UHFFFAOYSA-N |
| Molecular Weight | 224.28 |
| Solvent | Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian XL-100 |