| SpectraBase Compound ID | 7nBoxYxKDdw |
|---|---|
| InChI | InChI=1S/C7H8O3S.C3H3N3/c1-6-2-4-7(5-3-6)11(8,9)10;4-1-3(6)2-5/h2-5H,1H3,(H,8,9,10);3H,6H2 |
| InChIKey | MEUWQVWJLLBVQI-UHFFFAOYSA-N |
| Mol Weight | 253.28 g/mol |
| Molecular Formula | C10H11N3O3S |
| Exact Mass | 253.052112 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 1zeYspvhaJx |
|---|---|
| Name | Aminomalononitrile p-toluenesulfonate |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 221147 |
| CAS Registry Number | 5098-14-6 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H11N3O3S |
| InChI | InChI=1S/C7H8O3S.C3H3N3/c1-6-2-4-7(5-3-6)11(8,9)10;4-1-3(6)2-5/h2-5H,1H3,(H,8,9,10);3H,6H2 |
| InChIKey | MEUWQVWJLLBVQI-UHFFFAOYSA-N |
| Observed nucleus | 1H |
| Purity | 98% |
| Solvent | CDCl3 & DMSO-d6 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Wiley ID | SIAL_1HNMR_003236 |