| SpectraBase Spectrum ID |
2Qzi0o2yz2K |
| Name |
11-(1-Nonyldecyl)-3H-isobenzofuro[4',5',6',7':6,7]peryleno[1,12-efg]isoindol-3,5,10,12(11H)-tetraon |
| Appearance |
Brown solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C47H47NO5 |
| InChI |
InChI=1S/C47H47NO5/c1-3-5-7-9-11-13-15-17-29(18-16-14-12-10-8-6-4-2)48-44(49)40-30-23-19-27-21-25-32-38-34(27)36(30)37-31(41(40)45(48)50)24-20-28-22-26-33(39(38)35(28)37)43-42(32)46(51)53-47(43)52/h19-26,29H,3-18H2,1-2H3 |
| InChIKey |
KNAQGPNNAIKRHX-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Molecular Weight |
705.895 g/mol |
| Reported Formula |
C47H47NO5 |
| SMILES |
c1cc2ccc3c4c2c2c1c1c(c5c2c2c(cc5)ccc(c42)c2c3C(OC2=O)=O)C(N(C1=O)C(CCCCCCCCC)CCCCCCCCC)=O |
| SPLASH |
splash10-0udi-1000920200-c442c2ec7e79e42e8512 |
| Source of Spectrum |
DE102016010081A1 |
| Thin-Layer Chromatography |
Rf = 0.88 (silica gel, chloroform/glacial acetic acid 20:1) |
| Wiley ID |
1870609 |
![11-(1-Nonyldecyl)-3H-isobenzofuro[4',5',6',7':6,7]peryleno[1,12-efg]isoindol-3,5,10,12(11H)-tetraon](/api/spectrum/2Qzi0o2yz2K/structure.png?h=300&w=458 "11-(1-Nonyldecyl)-3H-isobenzofuro[4',5',6',7':6,7]peryleno[1,12-efg]isoindol-3,5,10,12(11H)-tetraon")
