| SpectraBase Spectrum ID |
LQydQUoT1Qw |
| Name |
4,4'-((2S,3R,6R)-1-butyl-3-isobutyl-4-oxopiperidine-2,6-diyl)dibenzonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H31N3O |
| InChI |
InChI=1S/C27H31N3O/c1-4-5-14-30-25(22-10-6-20(17-28)7-11-22)16-26(31)24(15-19(2)3)27(30)23-12-8-21(18-29)9-13-23/h6-13,19,24-25,27H,4-5,14-16H2,1-3H3/t24-,25+,27+/m0/s1 |
| InChIKey |
NBWURMHQAHRAFO-ZWEKWIFMSA-N |
| Literature Reference DOI |
10.1002/cjoc.201100717 |
| Molecular Weight |
413.565 g/mol |
| SMILES |
C1[C@@](N([C@@]([C@](C1=O)(CC(C)C)[H])(c1ccc(cc1)C#N)[H])CCCC)(c1ccc(cc1)C#N)[H] |
| SPLASH |
splash10-054k-3901000000-513bf14e8319b36261fe |
| Source of Spectrum |
CJC-30-1509-4v |
| Wiley ID |
1772753 |
