SpectraBase Spectrum ID |
JCEncuttd7M |
Name |
4-(Benzo[b]thien-3-yl)-3-((4-(tert-butyl)phenyl)ethynyl)pyridine |
Appearance |
Yellow oil |
Carrier Gas |
Helium |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
367.139470854 u |
Formula |
C25H21NS |
InChI |
InChI=1S/C25H21NS/c1-25(2,3)20-12-9-18(10-13-20)8-11-19-16-26-15-14-21(19)23-17-27-24-7-5-4-6-22(23)24/h4-7,9-10,12-17H,1-3H3 |
InChIKey |
WTBGECCNNDRZDW-UHFFFAOYSA-N |
Instrument Name |
Finnigan MAT 95-XP |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/ejoc.202101306 |
Molecular Weight |
367.510 g/mol |
Quality |
386 |
Reported Formula |
C25H21NS |
SMILES |
C1=2SC=C(C2C=CC=C1)C1=C(C=NC=C1)C#CC1=CC=C(C=C1)C(C)(C)C |
SPLASH |
splash10-0wmi-1009000000-a97f4c79fb898e5adf5f |
Source of Spectrum |
K1-2022-SM15-2n (DOI: 10.1002/ejoc.202101306) |
Thin-Layer Chromatography |
0.35 (Heptane/EtOAc, 3:1) |
Wiley ID |
1899025 |