| SpectraBase Compound ID | DZPCl3FSPfR |
|---|---|
| InChI | InChI=1S/C12H17N2.CHF3O3S/c1-3-4-8-12(10-13)14-9-6-5-7-11(14)2;2-1(3,4)8(5,6)7/h5-7,9,12H,3-4,8H2,1-2H3;(H,5,6,7)/q+1;/p-1 |
| InChIKey | CUDRABKOEDFNEX-UHFFFAOYSA-M |
| Mol Weight | 338.35 g/mol |
| Molecular Formula | C13H17F3N2O3S |
| Exact Mass | 338.091198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LYYMOaubTAS |
|---|---|
| Name | 1-(1-CYANOPENTYL)-2-METHYL-PYRIDINIUM-TRIFLATE |
| Compound Number | 3A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C13H17F3N2O3S |
| InChI | InChI=1S/C12H17N2.CHF3O3S/c1-3-4-8-12(10-13)14-9-6-5-7-11(14)2;2-1(3,4)8(5,6)7/h5-7,9,12H,3-4,8H2,1-2H3;(H,5,6,7)/q+1;/p-1 |
| InChIKey | CUDRABKOEDFNEX-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 | 338.345 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWIR18962 |