| SpectraBase Spectrum ID |
D4e6N5IcCeT |
| Name |
4-Cyano-3-(pyrimidin-2-yl)phenyl 4-Methylbenzenesulfonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H13N3O3S |
| InChI |
InChI=1S/C18H13N3O3S/c1-13-3-7-16(8-4-13)25(22,23)24-15-6-5-14(12-19)17(11-15)18-20-9-2-10-21-18/h2-11H,1H3 |
| InChIKey |
AVFSNYIXVSRZQM-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/jo500087g |
| Molecular Weight |
351.380 g/mol |
| SMILES |
c1cnc(-c2cc(OS(c3ccc(cc3)C)(=O)=O)ccc2C#N)nc1 |
| SPLASH |
splash10-0a4l-9724000000-87f18b42a35aaa528df1 |
| Source of Spectrum |
J-79-3234-2n |
| Wiley ID |
1746138 |
