| SpectraBase Spectrum ID |
EG1tI9HdZdW |
| Name |
3,5-Bis(4-fluorobenzylidene)-1-[(2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrol-3-yl)methyl]piperidin-4-one |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H30F2N2O |
| InChI |
InChI=1S/C28H30F2N2O/c1-27(2)15-23(28(3,4)31-27)18-32-16-21(13-19-5-9-24(29)10-6-19)26(33)22(17-32)14-20-7-11-25(30)12-8-20/h5-15,31H,16-18H2,1-4H3/b21-13+,22-14+ |
| InChIKey |
NIGSYTPUHXAUCW-JFMUQQRKSA-N |
| Instrument Name |
Thermoquest Automass Multi and VG TRIO-4 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jm200353f |
| Molecular Weight |
448.558 g/mol |
| SMILES |
N1C(C=C(C1(C)C)CN1C\C(C(\C(=C\c2ccc(cc2)F)C1)=O)=C/c1ccc(cc1)F)(C)C |
| SPLASH |
splash10-00e9-0900000000-c8bfcb97a3a6b7bb4628 |
| Source of Spectrum |
AF-54-5419-5e |
| Thin-Layer Chromatography |
Rf = 0.31 (CHCl3/MeOH, 9:1) |
| Wiley ID |
1848670 |
![3,5-Bis(4-fluorobenzylidene)-1-[(2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrol-3-yl)methyl]piperidin-4-one](/api/spectrum/EG1tI9HdZdW/structure.png?h=300&w=458 "3,5-Bis(4-fluorobenzylidene)-1-[(2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrol-3-yl)methyl]piperidin-4-one")
