| SpectraBase Spectrum ID |
modmnvMRM |
| Name |
N,N'-Bis(2-(1-propylbutyl)-3-propylhexyl)perylene-3,4:9,10-bis(dicarboximide) |
| Alternate Name(s) |
2,9-Bis-[3-propyl-2-(1-propyl-butyl)-hexyl]-anthra[2,1,9-def;6,5,10-d'e'f']diisoquinoline-1,3,8,10-tetraone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C56H74N2O4 |
| InChI |
InChI=1S/C56H74N2O4/c1-9-17-35(18-10-2)47(36(19-11-3)20-12-4)33-57-53(59)43-29-25-39-41-27-31-45-52-46(32-28-42(50(41)52)40-26-30-44(54(57)60)51(43)49(39)40)56(62)58(55(45)61)34-48(37(21-13-5)22-14-6)38(23-15-7)24-16-8/h25-32,35-38,47-48H,9-24,33-34H2,1-8H3 |
| InChIKey |
HAJHATVWCFJOPD-UHFFFAOYSA-N |
| Molecular Weight |
839.218 g/mol |
| SMILES |
C1(N(C(c2c3c4c(ccc13)c1ccc3c5c1c(c4cc2)ccc5C(N(C3=O)CC(C(CCC)CCC)C(CCC)CCC)=O)=O)CC(C(CCC)CCC)C(CCC)CCC)=O |
| SPLASH |
splash10-052f-5009424230-4b8b1fc83e4587da3ed6 |
| Source of Spectrum |
F-56-5438-2 |
| Wiley ID |
857820 |
