SpectraBase Spectrum ID |
ATgel03N4s |
Name |
4-[2-[3-[2-[3,5-bis[2-[1-(2-pyridin-4-ylethynyl)-3-bicyclo[1.1.1]pentanyl]ethynyl]phenyl]ethynyl]-1-bicyclo[1.1.1]pentanyl]ethynyl]pyridine |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C48H33N3 |
InChI |
InChI=1S/C48H33N3/c1(37-7-19-49-20-8-37)13-43-28-46(29-43,30-43)16-4-40-25-41(5-17-47-31-44(32-47,33-47)14-2-38-9-21-50-22-10-38)27-42(26-40)6-18-48-34-45(35-48,36-48)15-3-39-11-23-51-24-12-39/h7-12,19-27H,28-36H2 |
InChIKey |
PRWFBVZVXDFQRR-UHFFFAOYSA-N |
Molecular Weight |
651.813 g/mol |
SMILES |
C12(C#Cc3cc(C#CC45CC(C5)(C#Cc5ccncc5)C4)cc(C#CC45CC(C4)(C#Cc4ccncc4)C5)c3)CC(C1)(C#Cc1ccncc1)C2 |
SPLASH |
splash10-052r-3311591000-8be3a1e4b00c65e4310d |
Source of Spectrum |
J-67-5484-5 |
Synonyms |
4-[2-[3-[2-[3,5-bis[2-[1-[2-(4-pyridyl)ethynyl]-3-bicyclo[1.1.1]pentanyl]ethynyl]phenyl]ethynyl]-1-bicyclo[1.1.1]pentanyl]ethynyl]pyridine |
Wiley ID |
1570493 |