| SpectraBase Spectrum ID |
B6fOA4DGkVl |
| Name |
N-(1-Hexylheptyl)-N'-(1-pyrenyl)perylene-3,4:9,10-tetracarboxylic bisimide |
| Alternate Name(s) |
2-(1-hexylheptyl)-9-(1-pyrenyl)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 |
C53H44N2O4 |
| InChI |
InChI=1S/C53H44N2O4/c1-3-5-7-9-14-33(15-10-8-6-4-2)54-50(56)39-25-21-34-36-23-27-41-49-42(28-24-37(47(36)49)35-22-26-40(51(54)57)48(39)46(34)35)53(59)55(52(41)58)43-29-19-32-17-16-30-12-11-13-31-18-20-38(43)45(32)44(30)31/h11-13,16-29,33H,3-10,14-15H2,1-2H3 |
| InChIKey |
ZQIGQJBBTGDICE-UHFFFAOYSA-N |
| Molecular Weight |
772.945 g/mol |
| SMILES |
C1(N(C(c2c3c4c(c5ccc6c7c5c(c4ccc13)ccc7C(N(C6=O)C(CCCCCC)CCCCCC)=O)cc2)=O)c1c2c3c4c(cccc4cc2)ccc3cc1)=O |
| SPLASH |
splash10-00dl-0005090500-7c6927b6e9eab5a0ff28 |
| Source of Spectrum |
QF-8-5640-9 |
| Wiley ID |
1558118 |
