SpectraBase Spectrum ID |
Lxj9RfQfNgT |
Name |
3-p-chlorophenyl-3-hydroxy-N-(4'-p-methylphenyl-4'-oxobutyl)quinuclidinium iodide |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C24H29ClINO2 |
InChI |
InChI=1S/C24H29ClNO2.HI/c1-18-4-6-19(7-5-18)23(27)3-2-14-26-15-12-21(13-16-26)24(28,17-26)20-8-10-22(25)11-9-20;/h4-11,21,28H,2-3,12-17H2,1H3;1H/q+1;/p-1 |
InChIKey |
KTHRFGJPPAAECR-UHFFFAOYSA-M |
Molecular Weight |
525.858 g/mol |
SMILES |
[I-].OC1(C[N+]2(CCC1CC2)CCCC(c1ccc(C)cc1)=O)c1ccc(Cl)cc1 |
SPLASH |
splash10-014i-2912010000-058d1396dfd31238f9ab |
Source of Spectrum |
Y-27-1460-22 |
Synonyms |
3-(4'-Chlorophenyl)-3-hydroxy-N-[4'-(4''-methylphenyl)-4'-oxobutyl]quinuclidnium iodide
3-(4-Chlorophenyl)-3-hydroxy-1-[4-(4-methylphenyl)-4-oxobutyl]-1-azoniabicyclo[2.2.2]octane iodide |
Wiley ID |
1402661 |