| SpectraBase Spectrum ID |
Ao9uGO7js6R |
| Name |
(2S,3R,6R)-1-butyl-3-isobutyl-2,6-bis(3-nitrophenyl)piperidin-4-one |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H31N3O5 |
| InChI |
InChI=1S/C25H31N3O5/c1-4-5-12-26-23(18-8-6-10-20(14-18)27(30)31)16-24(29)22(13-17(2)3)25(26)19-9-7-11-21(15-19)28(32)33/h6-11,14-15,17,22-23,25H,4-5,12-13,16H2,1-3H3/t22-,23+,25+/m0/s1 |
| InChIKey |
DFJJQVPTHAKXDJ-JBRSBNLGSA-N |
| Literature Reference DOI |
10.1002/cjoc.201100717 |
| Molecular Weight |
453.539 g/mol |
| SMILES |
C1[C@@](N([C@@]([C@](C1=O)(CC(C)C)[H])(c1cccc([N+](=O)[O-])c1)[H])CCCC)(c1cc(ccc1)[N+](=O)[O-])[H] |
| SPLASH |
splash10-03di-0940600000-fb2e93a72340c4147629 |
| Source of Spectrum |
CJC-30-1509-4u |
| Wiley ID |
1772752 |
