| SpectraBase Spectrum ID |
9uEf2VvGdQW |
| Name |
2-acetonylsulfanyl-4-(4-bromophenyl)-6-(3,4-dimethoxyphenyl)pyridine-3-carbonitrile |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H19BrN2O3S |
| InChI |
InChI=1S/C23H19BrN2O3S/c1-14(27)13-30-23-19(12-25)18(15-4-7-17(24)8-5-15)11-20(26-23)16-6-9-21(28-2)22(10-16)29-3/h4-11H,13H2,1-3H3 |
| InChIKey |
PXDWSLAAGHOTOO-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP 1000 EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.3392 |
| Molecular Weight |
483.380 g/mol |
| SMILES |
c1c(-c2cc(-c3ccc(OC)c(OC)c3)nc(SCC(=O)C)c2C#N)ccc(Br)c1 |
| SPLASH |
splash10-000i-0001900000-823a3d43f4433a23e211 |
| Source of Spectrum |
Y-56-178-9c |
| Wiley ID |
1859280 |
