| SpectraBase Compound ID | BhHrywk17eg |
|---|---|
| InChI | InChI=1S/C16H18O2S/c1-11-5-7-15(8-6-11)19(17,18)16-13(3)9-12(2)10-14(16)4/h5-10H,1-4H3 |
| InChIKey | CGPHOZWFSFNOEQ-UHFFFAOYSA-N |
| Mol Weight | 274.38 g/mol |
| Molecular Formula | C16H18O2S |
| Exact Mass | 274.102751 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7XPEzx0M7gz |
|---|---|
| Name | 1,3,5-trimethyl-2-tosylbenzene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H18O2S |
| InChI | InChI=1S/C16H18O2S/c1-11-5-7-15(8-6-11)19(17,18)16-13(3)9-12(2)10-14(16)4/h5-10H,1-4H3 |
| InChIKey | CGPHOZWFSFNOEQ-UHFFFAOYSA-N |
| Ionization Type | EI |
| SMILES | c1(c(cc(cc1C)C)C)S(c1ccc(cc1)C)(=O)=O |
| SPLASH | splash10-00mo-6940000000-fd6443b0e2e95bf563fe |
| Source of Spectrum | CN101293861B |
| Wiley ID | 1841435 |