| SpectraBase Spectrum ID |
9FUyHkJiC6Y |
| Name |
Diethyl 2,2'-({3,3'-[(propane-1,3-diylbis(oxy))bis(2,1-phenylene)]bis-(2-cyanoacryloyl)}bis(azanediyl))bis(4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate) |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C45H44N4O8S2 |
| InChI |
InChI=1S/C45H44N4O8S2/c1-3-54-44(52)38-32-16-7-11-20-36(32)58-42(38)48-40(50)30(26-46)24-28-14-5-9-18-34(28)56-22-13-23-57-35-19-10-6-15-29(35)25-31(27-47)41(51)49-43-39(45(53)55-4-2)33-17-8-12-21-37(33)59-43/h5-6,9-10,14-15,18-19,24-25H,3-4,7-8,11-13,16-17,20-23H2,1-2H3,(H,48,50)(H,49,51) |
| InChIKey |
ALHYQFFHQPOVNT-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu Qp-2010 plus |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ardp.202000069 |
| Molecular Weight |
832.987 g/mol |
| SMILES |
N(C(C(=Cc1ccccc1OCCCOc1ccccc1C=C(C(=O)Nc1c(C(OCC)=O)c2CCCCc2s1)C#N)C#N)=O)c1sc2c(CCCC2)c1C(OCC)=O |
| SPLASH |
splash10-0ab9-2001491100-62ea12c87c1eb452b117 |
| Source of Spectrum |
APC-353-SM6-7 |
| Wiley ID |
1855784 |
![Diethyl 2,2'-({3,3'-[(propane-1,3-diylbis(oxy))bis(2,1-phenylene)]bis-(2-cyanoacryloyl)}bis(azanediyl))bis(4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate)](/api/spectrum/9FUyHkJiC6Y/structure.png?h=300&w=458 "Diethyl 2,2'-({3,3'-[(propane-1,3-diylbis(oxy))bis(2,1-phenylene)]bis-(2-cyanoacryloyl)}bis(azanediyl))bis(4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate)")
