| SpectraBase Spectrum ID |
4iD77Oct48S |
| Name |
ethyl 2-[[4-(4-bromophenyl)-3-cyano-6-(3,4-dimethoxyphenyl)-2-pyridyl]sulfanyl]acetate |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H21BrN2O4S |
| InChI |
InChI=1S/C24H21BrN2O4S/c1-4-31-23(28)14-32-24-19(13-26)18(15-5-8-17(25)9-6-15)12-20(27-24)16-7-10-21(29-2)22(11-16)30-3/h5-12H,4,14H2,1-3H3 |
| InChIKey |
NAKMIDLYWIHPCK-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP 1000 EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.3392 |
| Molecular Weight |
513.406 g/mol |
| SMILES |
c1cc(ccc1Br)-c1cc(nc(c1C#N)SCC(OCC)=O)-c1ccc(c(c1)OC)OC |
| SPLASH |
splash10-02t9-0000960000-96227d2ce8a6e1356a88 |
| Source of Spectrum |
Y-56-177-9a |
| Wiley ID |
1859278 |
![ethyl 2-[[4-(4-bromophenyl)-3-cyano-6-(3,4-dimethoxyphenyl)-2-pyridyl]sulfanyl]acetate](/api/spectrum/4iD77Oct48S/structure.png?h=300&w=458 "ethyl 2-[[4-(4-bromophenyl)-3-cyano-6-(3,4-dimethoxyphenyl)-2-pyridyl]sulfanyl]acetate")
