| SpectraBase Spectrum ID |
39vcaNmNDE |
| Name |
(2S,3R,6R)-1-butyl-3-ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H27N3O5 |
| InChI |
InChI=1S/C23H27N3O5/c1-3-5-14-24-21(16-6-10-18(11-7-16)25(28)29)15-22(27)20(4-2)23(24)17-8-12-19(13-9-17)26(30)31/h6-13,20-21,23H,3-5,14-15H2,1-2H3/t20-,21+,23+/m0/s1 |
| InChIKey |
HMKITLZVDNPYSG-QZNHQXDQSA-N |
| Literature Reference DOI |
10.1002/cjoc.201100717 |
| Molecular Weight |
425.485 g/mol |
| SMILES |
C1[C@@](N([C@@]([C@](C1=O)(CC)[H])(c1ccc([N+]([O-])=O)cc1)[H])CCCC)(c1ccc([N+]([O-])=O)cc1)[H] |
| SPLASH |
splash10-01q9-0926000000-8be72293fcb1b394d044 |
| Source of Spectrum |
CJC-30-1508-4j |
| Wiley ID |
1772742 |
