| SpectraBase Spectrum ID |
3rZXrr4sULe |
| Name |
4-(Benzo[b]thien-3-yl)-3-((4-fluorophenyl)ethynyl)pyridine |
| Appearance |
Brown oil |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
329.067448727 u |
| Formula |
C21H12FNS |
| InChI |
InChI=1S/C21H12FNS/c22-17-9-6-15(7-10-17)5-8-16-13-23-12-11-18(16)20-14-24-21-4-2-1-3-19(20)21/h1-4,6-7,9-14H |
| InChIKey |
WAWXXXDSDMQPOX-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95-XP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202101306 |
| Molecular Weight |
329.392 g/mol |
| Quality |
190 |
| Reported Formula |
C21H12FNS |
| SMILES |
C1=2SC=C(C2C=CC=C1)C1=C(C=NC=C1)C#CC1=CC=C(C=C1)F |
| SPLASH |
splash10-004i-0109000000-98088bb2c68083370383 |
| Source of Spectrum |
K1-2022-SM18-2r (DOI: 10.1002/ejoc.202101306) |
| Thin-Layer Chromatography |
0.37 (Heptane/EtOAc, 3:1) |
| Wiley ID |
1899029 |
![4-(Benzo[b]thien-3-yl)-3-((4-fluorophenyl)ethynyl)pyridine](/api/spectrum/3rZXrr4sULe/structure.png?h=300&w=458 "4-(Benzo[b]thien-3-yl)-3-((4-fluorophenyl)ethynyl)pyridine")
