| SpectraBase Compound ID | FI0iIDgTIqR |
|---|---|
| InChI | InChI=1S/C10H17N2O.C2HF3O2/c1-11(2)10-4-7-12(8-5-10)6-3-9-13;3-2(4,5)1(6)7/h4-5,7-8,13H,3,6,9H2,1-2H3;(H,6,7)/q+1;/p-1 |
| InChIKey | BAWVSQHZBWEGKL-UHFFFAOYSA-M |
| Mol Weight | 294.27 g/mol |
| Molecular Formula | C12H17F3N2O3 |
| Exact Mass | 294.119127 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | zetHtBr1bm |
|---|---|
| Name | 4-(DIMETHYLAMINO)-1-(3-HYDROXYPROPYL)-PYRIDINIUM-TRIFLUOROACETATE |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C12H17F3N2O3 |
| InChI | InChI=1S/C10H17N2O.C2HF3O2/c1-11(2)10-4-7-12(8-5-10)6-3-9-13;3-2(4,5)1(6)7/h4-5,7-8,13H,3,6,9H2,1-2H3;(H,6,7)/q+1;/p-1 |
| InChIKey | BAWVSQHZBWEGKL-UHFFFAOYSA-M |
| Literature Reference Author | M.MESSALI |
| Literature Reference Citation | MOLECULES,20,14936(2015) |
| Literature Reference DOI | 10.3390/molecules200814936 |
| Solvent | DMSO |
| Source File Reference | UWPA5305 |