| SpectraBase Spectrum ID |
98aZEXLVgvh |
| Name |
4-(4-bromophenyl)-6-(3,4-dimethoxyphenyl)-2-phenacylsulfanyl-pyridine-3-carbonitrile |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H21BrN2O3S |
| InChI |
InChI=1S/C28H21BrN2O3S/c1-33-26-13-10-20(14-27(26)34-2)24-15-22(18-8-11-21(29)12-9-18)23(16-30)28(31-24)35-17-25(32)19-6-4-3-5-7-19/h3-15H,17H2,1-2H3 |
| InChIKey |
GGYXUIVXDLVXCD-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP 1000 EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.3392 |
| Molecular Weight |
545.451 g/mol |
| SMILES |
c1cc(Br)ccc1-c1cc(-c2ccc(OC)c(OC)c2)nc(SCC(c2ccccc2)=O)c1C#N |
| SPLASH |
splash10-0a4r-0901420000-4900bbefd1f808914b7c |
| Source of Spectrum |
Y-56-178-9b |
| Wiley ID |
1859279 |
