| SpectraBase Compound ID | 1JnopoEzW87 |
|---|---|
| InChI | InChI=1S/C8H12N2.CH4O3S/c1-9-7-5-8-4-2-3-6-10-8;1-5(2,3)4/h2-4,6,9H,5,7H2,1H3;1H3,(H,2,3,4) |
| InChIKey | FUWLKZQYMWTFBA-UHFFFAOYSA-N |
| Mol Weight | 232.3 g/mol |
| Molecular Formula | C9H16N2O3S |
| Exact Mass | 232.088164 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3I4jzZ8qNmi |
|---|---|
| Name | N-Methyl-2-(2-pyridyl)ethylamine methanesulfonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.088163554 u |
| Formula | C9H16N2O3S |
| InChI | InChI=1S/C8H12N2.CH4O3S/c1-9-7-5-8-4-2-3-6-10-8;1-5(2,3)4/h2-4,6,9H,5,7H2,1H3;1H3,(H,2,3,4) |
| InChIKey | FUWLKZQYMWTFBA-UHFFFAOYSA-N |
| Molecular Weight | 232.298 g/mol |
| SMILES | OS(C)(=O)=O.N(CCC1=CC=CC=N1)C |