![1-[CYANO-(CYCLOHEXYL)-METHYL]-2-METHYL-PYRIDINIUM-TRIFLATE](/api/spectrum/BgJ6zyEo9oc/structure.png?h=300&w=458 "1-[CYANO-(CYCLOHEXYL)-METHYL]-2-METHYL-PYRIDINIUM-TRIFLATE")
| SpectraBase Compound ID | 2D84oqgsoEj |
|---|---|
| InChI | InChI=1S/C14H19N2.CHF3O3S/c1-12-7-5-6-10-16(12)14(11-15)13-8-3-2-4-9-13;2-1(3,4)8(5,6)7/h5-7,10,13-14H,2-4,8-9H2,1H3;(H,5,6,7)/q+1;/p-1 |
| InChIKey | VCZUQBXQNQGLHJ-UHFFFAOYSA-M |
| Mol Weight | 364.38 g/mol |
| Molecular Formula | C15H19F3N2O3S |
| Exact Mass | 364.106848 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BgJ6zyEo9oc |
|---|---|
| Name | 1-[CYANO-(CYCLOHEXYL)-METHYL]-2-METHYL-PYRIDINIUM-TRIFLATE |
| Compound Number | 3F |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C15H19F3N2O3S |
| InChI | InChI=1S/C14H19N2.CHF3O3S/c1-12-7-5-6-10-16(12)14(11-15)13-8-3-2-4-9-13;2-1(3,4)8(5,6)7/h5-7,10,13-14H,2-4,8-9H2,1H3;(H,5,6,7)/q+1;/p-1 |
| InChIKey | VCZUQBXQNQGLHJ-UHFFFAOYSA-M |
| Literature Reference Author | M.KUCUKDISLI,T.OPATZ |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2014,5836(2014) |
| Literature Reference DOI | 10.1002/ejoc.201402618 |
| Molecular Weight | 364.383 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWIR18966 |