| SpectraBase Spectrum ID |
IAr9KFgNUjd |
| Name |
(2S,3R,6R)-1-butyl-3-isobutyl-2,6-bis(4-nitrophenyl)piperidin-4-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H31N3O5 |
| InChI |
InChI=1S/C25H31N3O5/c1-4-5-14-26-23(18-6-10-20(11-7-18)27(30)31)16-24(29)22(15-17(2)3)25(26)19-8-12-21(13-9-19)28(32)33/h6-13,17,22-23,25H,4-5,14-16H2,1-3H3/t22-,23+,25+/m0/s1 |
| InChIKey |
VGDVXAPEHMBCCG-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])(c1ccc(cc1)[N+]([O-])=O)[H])CCCC)(c1ccc([N+]([O-])=O)cc1)[H] |
| SPLASH |
splash10-01ot-3910300000-b6c0050aa11ac11168c9 |
| Source of Spectrum |
CJC-30-1509-4t |
| Wiley ID |
1772751 |
