| SpectraBase Compound ID | IWXCx5JlyRX |
|---|---|
| InChI | InChI=1S/C9H10O2S/c10-12(11)6-5-8-3-1-2-4-9(8)7-12/h1-4H,5-7H2 |
| InChIKey | BITDJSNZRJVSCJ-UHFFFAOYSA-N |
| Mol Weight | 182.24 g/mol |
| Molecular Formula | C9H10O2S |
| Exact Mass | 182.040151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KdIssjWDk8u |
|---|---|
| Name | ISOTHIOCHROMAN, 2,2-DIOXIDE |
| Source of Sample | W. Adcock, B. D. Gupta, W. Kitching J. Org. Chem. 41, 1498(1976) |
| CAS Registry Number | 18436-01-6 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H10O2S |
| InChI | InChI=1S/C9H10O2S/c10-12(11)6-5-8-3-1-2-4-9(8)7-12/h1-4H,5-7H2 |
| InChIKey | BITDJSNZRJVSCJ-UHFFFAOYSA-N |
| Molecular Weight | 182.24 |
| Solvent | Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WH-90 |