| SpectraBase Spectrum ID |
82oCooKAltt |
| Name |
(Z)-5-((5'-(4-(Diphenylamino)phenyl)-3,4'-dihexyl-[2,2'-bithiophen]-5-yl)methylene)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile |
| Appearance |
Dark purple solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C46H47N3O2S2 |
| InChI |
InChI=1S/C46H47N3O2S2/c1-4-6-8-12-18-34-28-39(30-40-32(3)41(31-47)46(51)48-45(40)50)52-44(34)42-29-35(19-13-9-7-5-2)43(53-42)33-24-26-38(27-25-33)49(36-20-14-10-15-21-36)37-22-16-11-17-23-37/h10-11,14-17,20-30H,4-9,12-13,18-19H2,1-3H3,(H,48,50,51)/b40-30- |
| InChIKey |
VKTMJUIVEGJKFT-DFGGBBJBSA-N |
| Instrument Name |
ThermoQuest MAT95XL |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.9.122 |
| Molecular Weight |
738.021 g/mol |
| Reported Formula |
C46H47N3O2(32)S2 |
| SMILES |
N1C(\C(C(=C(C1=O)C#N)C)=C\c1sc(-c2cc(c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)CCCCCC)c(c1)CCCCCC)=O |
| SPLASH |
splash10-052s-9000000300-bf8bf8b001b041bf1c16 |
| Source of Spectrum |
BJO-9-SM4-2 |
| Thin-Layer Chromatography |
Rf = 0.63 (CH2Cl2/5% CH3OH) |
| Wiley ID |
1853661 |
![(Z)-5-((5'-(4-(Diphenylamino)phenyl)-3,4'-dihexyl-[2,2'-bithiophen]-5-yl)methylene)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile](/api/spectrum/82oCooKAltt/structure.png?h=300&w=458 "(Z)-5-((5'-(4-(Diphenylamino)phenyl)-3,4'-dihexyl-[2,2'-bithiophen]-5-yl)methylene)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile")
