![6-Methoxy-4-[[6-(1,1-difluoroethyl)-1-azabicyclo[3.2.1]octan-2-yl]hydroxymethyl]quinidine isomer](/api/spectrum/4r192glM48/structure.png?h=300&w=458 "6-Methoxy-4-[[6-(1,1-difluoroethyl)-1-azabicyclo[3.2.1]octan-2-yl]hydroxymethyl]quinidine isomer")
| SpectraBase Compound ID | 4hGrO6l5hK3 |
|---|---|
| InChI | InChI=1S/C20H24F2N2O2/c1-20(21,22)15-5-3-11-9-17(15)24-18(11)19(25)13-7-8-23-16-6-4-12(26-2)10-14(13)16/h4,6-8,10-11,15,17-19,24-25H,3,5,9H2,1-2H3/t11-,15?,17-,18?,19+/m0/s1 |
| InChIKey | FCXKJWBZKSJYKK-XXGLKDPRSA-N |
| Mol Weight | 362.42 g/mol |
| Molecular Formula | C20H24F2N2O2 |
| Exact Mass | 362.180584 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4r192glM48 |
|---|---|
| Name | 6-Methoxy-4-[[6-(1,1-difluoroethyl)-1-azabicyclo[3.2.1]octan-2-yl]hydroxymethyl]quinidine isomer |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H24F2N2O2 |
| InChI | InChI=1S/C20H24F2N2O2/c1-20(21,22)15-5-3-11-9-17(15)24-18(11)19(25)13-7-8-23-16-6-4-12(26-2)10-14(13)16/h4,6-8,10-11,15,17-19,24-25H,3,5,9H2,1-2H3/t11-,15?,17-,18?,19+/m0/s1 |
| InChIKey | FCXKJWBZKSJYKK-XXGLKDPRSA-N |
| Molecular Weight | 362.421 g/mol |
| SMILES | N1C([C@@](c2c3c(ccc(c3)OC)ncc2)(O)[H])[C@]2(CCC([C@@]1(C2)[H])C(F)(F)C)[H] |
| SPLASH | splash10-03k9-0924000000-628245943853c51a3c66 |
| Source of Spectrum | F-20-670-11 |
| Wiley ID | 1631904 |