| SpectraBase Spectrum ID |
54NCNvgBv5M |
| Name |
5-((1'S,2'S,4'S,5'S)-2'-Hydroxymethyl-1'-azabicyclo[2.2.2]oct-5'-yl)-3-phenyl-(E/Z)-2-penten-4-ynoic acid ethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25NO3 |
| InChI |
InChI=1S/C21H25NO3/c1-2-25-21(24)13-17(16-6-4-3-5-7-16)8-9-19-14-22-11-10-18(19)12-20(22)15-23/h3-7,13,18-20,23H,2,10-12,14-15H2,1H3/b17-13-/t18-,19-,20-/m0/s1 |
| InChIKey |
URDBIFYAYRSDLN-NBXSSPSTSA-N |
| Molecular Weight |
339.435 g/mol |
| SMILES |
OC[C@@]1(C[C@]2([C@@](C#C\C(=C\C(=O)OCC)c3ccccc3)(CN1CC2)[H])[H])[H] |
| SPLASH |
splash10-01ti-0097000000-04ff1f1ed9f23404e883 |
| Source of Spectrum |
F-65-6232-9b |
| Wiley ID |
1680203 |
![5-((1'S,2'S,4'S,5'S)-2'-Hydroxymethyl-1'-azabicyclo[2.2.2]oct-5'-yl)-3-phenyl-(E/Z)-2-penten-4-ynoic acid ethyl ester](/api/spectrum/54NCNvgBv5M/structure.png?h=300&w=458 "5-((1'S,2'S,4'S,5'S)-2'-Hydroxymethyl-1'-azabicyclo[2.2.2]oct-5'-yl)-3-phenyl-(E/Z)-2-penten-4-ynoic acid ethyl ester")
