| SpectraBase Spectrum ID |
D2bFNBc3Cx0 |
| Name |
4-(Thien-3-yl)-3-((4-(trifluoromethyl)phenyl)ethynyl)pyridine |
| Appearance |
Yellow solid |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H10F3NS |
| InChI |
InChI=1S/C18H10F3NS/c19-18(20,21)16-5-2-13(3-6-16)1-4-14-11-22-9-7-17(14)15-8-10-23-12-15/h2-3,5-12H |
| InChIKey |
KOIAANNTWVSFDH-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95-XP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202101306 |
| Molecular Weight |
329.340 g/mol |
| Quality |
244 |
| Reported Formula |
C18H10NF3S |
| SMILES |
C1(=CC=C(C=C1)C(F)(F)F)C#CC=1C=NC=CC1C1=CSC=C1 |
| SPLASH |
splash10-004i-2029000000-e9280f114f40bf5a048c |
| Source of Spectrum |
K1-2022-SM10-2d (DOI: 10.1002/ejoc.202101306) |
| Thin-Layer Chromatography |
0.20 (Heptane/EtOAc, 5:1) |
| Wiley ID |
1899015 |
