| SpectraBase Spectrum ID |
2H2xBJXPx6t |
| Name |
3-((4-(tert-Butyl)phenyl)ethynyl)-4-(thien-3-yl)pyridine |
| Appearance |
Yellow 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/c1-21(2,3)19-8-5-16(6-9-19)4-7-17-14-22-12-10-20(17)18-11-13-23-15-18/h5-6,8-15H,1-3H3 |
| InChIKey |
YEWZRJJMESGNAV-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 |
103 |
| Reported Formula |
C21H19NS |
| SMILES |
C1(=CC=C(C=C1)C(C)(C)C)C#CC=1C=NC=CC1C1=CSC=C1 |
| SPLASH |
splash10-0udi-0019000000-9878341863b0ee00874a |
| Source of Spectrum |
K1-2022-SM10-2e (DOI: 10.1002/ejoc.202101306) |
| Thin-Layer Chromatography |
0.26 (Heptane/EtOAc, 5:1) |
| Wiley ID |
1899016 |
