SpectraBase Spectrum ID |
GqvG06gNdfq |
Name |
8-endo-4-Cyano-8-ethoxy-2-phenyl-2,5-diazabicyclo[2.2.2]octane-3-one isomer |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H15N3O3 |
InChI |
InChI=1S/C15H15N3O3/c1-2-21-12-8-11-13(19)17-15(12,9-16)14(20)18(11)10-6-4-3-5-7-10/h3-7,11-12H,2,8H2,1H3,(H,17,19)/t11-,12+,15-/m0/s1 |
InChIKey |
NFLSWWDSEYSRRH-ZOWXZIJZSA-N |
Molecular Weight |
285.303 g/mol |
SMILES |
N1C([C@]2(N(C([C@@]1([C@@](C2)(OCC)[H])C#N)=O)c1ccccc1)[H])=O |
SPLASH |
splash10-03di-0590000000-9a0818e4f10aedfd933c |
Source of Spectrum |
KC-57-3218-18 |
Wiley ID |
1623740 |