| SpectraBase Compound ID | ChkcePbLFfp |
|---|---|
| InChI | InChI=1S/C9H12O6S2/c1-7-4-5-8(16(10,11)14-2)6-9(7)17(12,13)15-3/h4-6H,1-3H3 |
| InChIKey | PICJGYUAPMCUDP-UHFFFAOYSA-N |
| Mol Weight | 280.31 g/mol |
| Molecular Formula | C9H12O6S2 |
| Exact Mass | 280.00753 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2scf2U0UqvQ |
|---|---|
| Name | Dimethyl 4-methylbenzene-1,3-disulfonate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H12O6S2 |
| InChI | InChI=1S/C9H12O6S2/c1-7-4-5-8(16(10,11)14-2)6-9(7)17(12,13)15-3/h4-6H,1-3H3 |
| InChIKey | PICJGYUAPMCUDP-UHFFFAOYSA-N |
| Molecular Weight | 280.309 g/mol |
| SMILES | COS(=O)(=O)c1ccc(C)c(c1)S(=O)(=O)OC |
| SPLASH | splash10-004i-9100000000-9bbf6a7476ad7bbcd9fe |
| Source of Spectrum | JX-2015-2-927 |
| Wiley ID | 1722612 |