| SpectraBase Spectrum ID |
5Sxdg8Ou644 |
| Name |
(+)-1-[(R)-4-BUTYL-2-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-2-(3,4-DICHLOROPHENYL)-ETHAN-1-ONE;MAJOR-ROTAMER |
| Compound Number |
(R,S)-22 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C22H33Cl2N3O |
| InChI |
InChI=1S/C22H33Cl2N3O/c1-3-4-9-25-12-13-27(21(16-25)17(2)26-10-5-6-11-26)22(28)15-18-7-8-19(23)20(24)14-18/h7-8,14,17,21H,3-6,9-13,15-16H2,1-2H3/t17-,21-/m0/s1 |
| InChIKey |
GXELPJLAYDYLJB-UWJYYQICSA-N |
| Literature Reference Author |
S.SOUKARA,C.A.MAIER,U.PREDOIU,A.EHRET,R.JACKISCH,B.WUENSCH |
| Literature Reference Citation |
J.MED.CHEM.,44,2814(2001) |
| Literature Reference DOI |
10.1021/jm0108395 |
| Molecular Weight |
426.430 g/mol |
| Sample ID |
45016 |
| Solvent |
C6D5NO2 |
![(+)-1-[(R)-4-BUTYL-2-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-2-(3,4-DICHLOROPHENYL)-ETHAN-1-ONE;MAJOR-ROTAMER](/api/spectrum/5Sxdg8Ou644/structure.png?h=300&w=458 "(+)-1-[(R)-4-BUTYL-2-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-2-(3,4-DICHLOROPHENYL)-ETHAN-1-ONE;MAJOR-ROTAMER")
