SpectraBase Spectrum ID |
4Mn2Cak82l5 |
Name |
5,11,17,23-tetrakis(Phenylethynyl)-25,26,27,28-tetra-(n-propoxy)calix[4]arene |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C72H64O4 |
InChI |
InChI=1S/C72H64O4/c1-5-37-73-69-61-41-57(33-29-53-21-13-9-14-22-53)42-62(69)50-64-44-59(35-31-55-25-17-11-18-26-55)46-66(71(64)75-39-7-3)52-68-48-60(36-32-56-27-19-12-20-28-56)47-67(72(68)76-40-8-4)51-65-45-58(34-30-54-23-15-10-16-24-54)43-63(49-61)70(65)74-38-6-2/h9-28,41-48H,5-8,37-40,49-52H2,1-4H3 |
InChIKey |
LLCRJYPGGDKRBL-UHFFFAOYSA-N |
Molecular Weight |
993.300 g/mol |
SMILES |
c12c(c(Cc3c(c(Cc4c(c(Cc5c(c(C1)cc(C#Cc1ccccc1)c5)OCCC)cc(C#Cc1ccccc1)c4)OCCC)cc(C#Cc1ccccc1)c3)OCCC)cc(C#Cc1ccccc1)c2)OCCC |
SPLASH |
splash10-0006-2000000009-070b60b8e990217ffe2f |
Source of Spectrum |
H-2005-3808-3 |
Wiley ID |
1563154 |