| SpectraBase Compound ID | BC2xpUGwBq |
|---|---|
| InChI | InChI=1S/C9H12O2S/c1-7-5-4-6-9(8(7)2)12(3,10)11/h4-6H,1-3H3 |
| InChIKey | FYWAJRTVIKZVRF-UHFFFAOYSA-N |
| Mol Weight | 184.25 g/mol |
| Molecular Formula | C9H12O2S |
| Exact Mass | 184.055801 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7QDK3LIIfxT |
|---|---|
| Name | 1-Mesyl-2,3-dimethyl-benzene |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H12O2S |
| InChI | InChI=1S/C9H12O2S/c1-7-5-4-6-9(8(7)2)12(3,10)11/h4-6H,1-3H3 |
| InChIKey | FYWAJRTVIKZVRF-UHFFFAOYSA-N |
| Molecular Weight | 184.253 g/mol |
| SMILES | c1(S(=O)(=O)C)c(c(ccc1)C)C |
| SPLASH | splash10-0fc0-7900000000-e17a33059ed6d1a2750a |
| Source of Spectrum | K1-2004-4638-20 |
| Synonyms | 1,2-Dimethyl-3-methylsulfonylbenzene |
| Wiley ID | 1561966 |