SpectraBase Spectrum ID |
4wukQ6VyW1k |
Name |
1,1'-ethyne-1,2-diylbis[7-tert-butyl-2-(methoxymethoxy)pyrene] |
Appearance |
Yellow crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
658.308309828 u |
Formula |
C46H42O4 |
InChI |
InChI=1S/C46H42O4/c1-45(2,3)33-19-27-9-11-31-23-39(49-25-47-7)35(37-15-13-29(21-33)41(27)43(31)37)17-18-36-38-16-14-30-22-34(46(4,5)6)20-28-10-12-32(44(38)42(28)30)24-40(36)50-26-48-8/h9-16,19-24H,25-26H2,1-8H3 |
InChIKey |
DVQRNGNNPBWKAS-UHFFFAOYSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201500826 |
Molecular Weight |
658.838 g/mol |
Quality |
76 |
Reported Formula |
C46H42O4 |
SMILES |
C1=CC2=C3C=4C1=CC(=CC4C=CC3=CC(=C2C#CC1=C2C3=C(C=C1OCOC)C=CC1=C3C(C=C2)=CC(=C1)C(C)(C)C)OCOC)C(C)(C)C |
SPLASH |
splash10-0a59-2010098000-e0dba91a85f760484bc4 |
Source of Spectrum |
QE-21-SM5-9 (DOI: 10.1002/chem.201500826) |
Wiley ID |
1909112 |