| SpectraBase Spectrum ID |
Fcjnxx4ZgfE |
| Name |
2,11-Bis(1-hexylheptyl)benzo[13,14]pentapheno[3,4,5-def:10,9,8-d'e'f']diisoquinolin-1,3,10,12(2H,11H)-tetraone |
| Appearance |
Blue solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C60H66N2O4 |
| InChI |
InChI=1S/C60H66N2O4/c1-5-9-13-17-21-37(22-18-14-10-6-2)61-57(63)47-33-29-43-39-25-27-41-45-31-35-49-56-50(60(66)62(59(49)65)38(23-19-15-11-7-3)24-20-16-12-8-4)36-32-46(54(45)56)42-28-26-40(51(39)52(41)42)44-30-34-48(58(61)64)55(47)53(43)44/h25-38H,5-24H2,1-4H3 |
| InChIKey |
XXNRBBOCUUSHPQ-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Molecular Weight |
879.198 g/mol |
| Reported Formula |
C60H66N2O4 |
| SMILES |
c12ccc3C(=O)N(C(CCCCCC)CCCCCC)C(=O)c4c3c1c(cc4)c1c3c2ccc2c3c(cc1)c1c3c2ccc2c3c(cc1)C(N(C2=O)C(CCCCCC)CCCCCC)=O |
| SPLASH |
splash10-002e-9000004030-1a048d7e52b723796b92 |
| Source of Spectrum |
EP2925817A2 |
| Thin-Layer Chromatography |
Rf = 0.35 (silica gel/chloroform) |
| Wiley ID |
1850478 |
![2,11-Bis(1-hexylheptyl)benzo[13,14]pentapheno[3,4,5-def:10,9,8-d'e'f']diisoquinolin-1,3,10,12(2H,11H)-tetraone](/api/spectrum/Fcjnxx4ZgfE/structure.png?h=300&w=458 "2,11-Bis(1-hexylheptyl)benzo[13,14]pentapheno[3,4,5-def:10,9,8-d'e'f']diisoquinolin-1,3,10,12(2H,11H)-tetraone")
