| SpectraBase Spectrum ID |
DxqGv5ZFZO2 |
| Name |
6-Hexylbenzo[4,5]thieno[3,2-f]isoquinoline |
| Appearance |
Yellow solid |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
319.139470854 u |
| Formula |
C21H21NS |
| InChI |
InChI=1S/C21H21NS/c1-2-3-4-5-8-15-13-16-14-22-12-11-17(16)20-18-9-6-7-10-19(18)23-21(15)20/h6-7,9-14H,2-5,8H2,1H3 |
| InChIKey |
CLQBPFIAJOZHHD-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95-XP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202101306 |
| Molecular Weight |
319.466 g/mol |
| Quality |
233 |
| Reported Formula |
C21H21NS |
| SMILES |
C=1(C2=C(C=3C=CN=CC3C1)C1=C(S2)C=CC=C1)CCCCCC |
| SPLASH |
splash10-0002-1093000000-d06e7c5ca8ed36f35586 |
| Source of Spectrum |
K1-2022-SM32-3s (DOI: 10.1002/ejoc.202101306) |
| Thin-Layer Chromatography |
0.35 (Heptane/EtOAc, 1.5:1) |
| Wiley ID |
1899051 |
![6-Hexylbenzo[4,5]thieno[3,2-f]isoquinoline](/api/spectrum/DxqGv5ZFZO2/structure.png?h=300&w=458 "6-Hexylbenzo[4,5]thieno[3,2-f]isoquinoline")
