SpectraBase Compound ID | 2wiyOFyh5Jk |
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InChI | InChI=1S/C13H16ClN3O2S/c1-8-5-6-11(9(2)7-8)16-20(18,19)12-10(3)15-17(4)13(12)14/h5-7,16H,1-4H3 |
InChIKey | MJVUESRSLFWWKR-UHFFFAOYSA-N |
Mol Weight | 313.8 g/mol |
Molecular Formula | C13H16ClN3O2S |
Exact Mass | 313.065176 g/mol |
SpectraBase Spectrum ID | CBRMflNezhC |
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Name | 5-chloro-1,3-dimethylpyrazole-4-sulfono-2',4'-xylidide |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C13H16ClN3O2S |
InChI | InChI=1S/C13H16ClN3O2S/c1-8-5-6-11(9(2)7-8)16-20(18,19)12-10(3)15-17(4)13(12)14/h5-7,16H,1-4H3 |
InChIKey | MJVUESRSLFWWKR-UHFFFAOYSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 56319M |
Solvent | CDCl3 |