| SpectraBase Spectrum ID |
8rZO3Wj32JW |
| Name |
4-(Benzo[b]thien-3-yl)-3-(oct-1-yn-1-yl)pyridine |
| Appearance |
Brown oil |
| 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/c1-2-3-4-5-6-7-10-17-15-22-14-13-18(17)20-16-23-21-12-9-8-11-19(20)21/h8-9,11-16H,2-6H2,1H3 |
| InChIKey |
CCFLUWGBRLQADL-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 |
250 |
| Reported Formula |
C21H21NS |
| SMILES |
C1=2SC=C(C2C=CC=C1)C1=C(C=NC=C1)C#CCCCCCC |
| SPLASH |
splash10-0002-0090000000-801bb74f876fe226d478 |
| Source of Spectrum |
K1-2022-SM19-2t (DOI: 10.1002/ejoc.202101306) |
| Thin-Layer Chromatography |
0.35 (Heptane/EtOAc, 3:1) |
| Wiley ID |
1899031 |
![4-(Benzo[b]thien-3-yl)-3-(oct-1-yn-1-yl)pyridine](/api/spectrum/8rZO3Wj32JW/structure.png?h=300&w=458 "4-(Benzo[b]thien-3-yl)-3-(oct-1-yn-1-yl)pyridine")
