![6-Methoxy-4-[[7-(1,1-difluoroethyl)-1-azabicyclo[2.2.2]octan-2-yl]acetoxymethyl]quinidine](/api/spectrum/E83L58uy0Yd/structure.png?h=300&w=458 "6-Methoxy-4-[[7-(1,1-difluoroethyl)-1-azabicyclo[2.2.2]octan-2-yl]acetoxymethyl]quinidine")
| SpectraBase Compound ID | 1BrgwL8K0mq |
|---|---|
| InChI | InChI=1S/C22H26F2N2O3/c1-13(27)29-21(16-6-8-25-19-5-4-15(28-3)11-17(16)19)20-10-14-7-9-26(20)12-18(14)22(2,23)24/h4-6,8,11,14,18,20-21H,7,9-10,12H2,1-3H3/t14-,18-,20-,21+/m1/s1 |
| InChIKey | HYBFSDXPIRZMAJ-STCFGPAYSA-N |
| Mol Weight | 404.46 g/mol |
| Molecular Formula | C22H26F2N2O3 |
| Exact Mass | 404.191149 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | E83L58uy0Yd |
|---|---|
| Name | 6-Methoxy-4-[[7-(1,1-difluoroethyl)-1-azabicyclo[2.2.2]octan-2-yl]acetoxymethyl]quinidine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H26F2N2O3 |
| InChI | InChI=1S/C22H26F2N2O3/c1-13(27)29-21(16-6-8-25-19-5-4-15(28-3)11-17(16)19)20-10-14-7-9-26(20)12-18(14)22(2,23)24/h4-6,8,11,14,18,20-21H,7,9-10,12H2,1-3H3/t14-,18-,20-,21+/m1/s1 |
| InChIKey | HYBFSDXPIRZMAJ-STCFGPAYSA-N |
| Molecular Weight | 404.458 g/mol |
| SMILES | [C@@]1(N2CC[C@](C1)([C@@](C2)(C(F)(F)C)[H])[H])([C@](c1c2c(ccc(c2)OC)ncc1)(OC(=O)C)[H])[H] |
| SPLASH | splash10-0fdk-0708900000-22c1fea89ca34a79a096 |
| Source of Spectrum | F-20-668-6 |
| Wiley ID | 1631910 |