| SpectraBase Compound ID | 3Ddg7dG9fui |
|---|---|
| InChI | InChI=1S/C7H7ClO3S/c1-5-2-3-6(8)4-7(5)12(9,10)11/h2-4H,1H3,(H,9,10,11) |
| InChIKey | OTIVVZBPDZOCBM-UHFFFAOYSA-N |
| Mol Weight | 206.64 g/mol |
| Molecular Formula | C7H7ClO3S |
| Exact Mass | 205.980443 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LbgLOgHkhDr |
|---|---|
| Name | 3-CHLORO-6-METHYL-BENZENESULFONIC-ACID |
| Compound Number | 221 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C7H7ClO3S |
| InChI | InChI=1S/C7H7ClO3S/c1-5-2-3-6(8)4-7(5)12(9,10)11/h2-4H,1H3,(H,9,10,11) |
| InChIKey | OTIVVZBPDZOCBM-UHFFFAOYSA-N |
| Literature Reference Author | W.ROBIEN |
| Literature Reference Citation | W.ROBIEN,PRIVATE_COMMUNICATION |
| Molecular Weight | 206.644 g/mol |
| Sample ID | 3539 |
| Solvent | DMSO-D6 |