SpectraBase Spectrum ID |
7iYm5FxhIxB |
Name |
9-(Heptyloctyl)-2-(2'-hydroxyethyl)]-anthra[2,1,9-def : 6,5,10-d'e'f']diisoquinoline-1,3,8,10-tetraone |
Alternate Name(s) |
N-(1-Heptyloctyl)-N'-(2-hydroxyethyl)perylene-3,4:9,10-tetracarboxylic diimide
2-(1-heptyloctyl)-9-(2-hydroxyethyl)isoquino[6',5',4':10,5,6]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C41H44N2O5 |
InChI |
InChI=1S/C41H44N2O5/c1-3-5-7-9-11-13-25(14-12-10-8-6-4-2)43-40(47)32-21-17-28-26-15-19-30-36-31(39(46)42(23-24-44)38(30)45)20-16-27(34(26)36)29-18-22-33(41(43)48)37(32)35(28)29/h15-22,25,44H,3-14,23-24H2,1-2H3 |
InChIKey |
UKHPLHZYJZRLAR-UHFFFAOYSA-N |
Molecular Weight |
644.812 g/mol |
SMILES |
OCCN1C(c2ccc3c4c2c(C1=O)ccc4c1c2c4c(C(N(C(c4cc1)=O)C(CCCCCCC)CCCCCCC)=O)ccc32)=O |
SPLASH |
splash10-0006-0009605000-a3522474b1291755b2a8 |
Source of Spectrum |
H-2005-4317-0 |
Wiley ID |
1587830 |