| SpectraBase Spectrum ID |
7qRpW68XHtg |
| Name |
4-(Benzo[b]thien-3-yl)-3-(cyclohexylethynyl)pyridine |
| Appearance |
Brown oil |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
317.123820790 u |
| Formula |
C21H19NS |
| InChI |
InChI=1S/C21H19NS/c1-2-6-16(7-3-1)10-11-17-14-22-13-12-18(17)20-15-23-21-9-5-4-8-19(20)21/h4-5,8-9,12-16H,1-3,6-7H2 |
| InChIKey |
NMKMGAVGXPKNOD-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95-XP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202101306 |
| Molecular Weight |
317.450 g/mol |
| Quality |
350 |
| Reported Formula |
C21H19NS |
| SMILES |
C1=2SC=C(C2C=CC=C1)C1=C(C=NC=C1)C#CC1CCCCC1 |
| SPLASH |
splash10-000j-1093000000-9476fac1751baf24738f |
| Source of Spectrum |
K1-2022-SM16-2o (DOI: 10.1002/ejoc.202101306) |
| Thin-Layer Chromatography |
0.35 (Heptane/EtOAc, 3:1) |
| Wiley ID |
1899026 |
![4-(Benzo[b]thien-3-yl)-3-(cyclohexylethynyl)pyridine](/api/spectrum/7qRpW68XHtg/structure.png?h=300&w=458 "4-(Benzo[b]thien-3-yl)-3-(cyclohexylethynyl)pyridine")
