SpectraBase Compound ID | C78Dvuya9Iu |
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InChI | InChI=1S/C7H8O3S.C6H7ClN/c1-6-2-4-7(5-3-6)11(8,9)10;1-8-5-3-2-4-6(8)7/h2-5H,1H3,(H,8,9,10);2-5H,1H3/q;+1/p-1 |
InChIKey | KWNGIKVZXFFZNN-UHFFFAOYSA-M |
Mol Weight | 299.77 g/mol |
Molecular Formula | C13H14ClNO3S |
Exact Mass | 299.038292 g/mol |
SpectraBase Spectrum ID | CufnRR3CBqM |
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Name | 2-Chloro-1-methylpyridinium p-toluenesulfonate |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 280402 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C13H14ClNO3S |
InChI | InChI=1S/C7H8O3S.C6H7ClN/c1-6-2-4-7(5-3-6)11(8,9)10;1-8-5-3-2-4-6(8)7/h2-5H,1H3,(H,8,9,10);2-5H,1H3/q;+1/p-1 |
InChIKey | KWNGIKVZXFFZNN-UHFFFAOYSA-M |
Molecular Weight | 299.772 g/mol |
Observed nucleus | 1H |
Solvent | CDCl3 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_1HNMR_013415 |