| SpectraBase Spectrum ID |
DTskASItlzp |
| Name |
Toluene-4-sulfonic Acid 3-Cyano-4-pyrimidin-2-yl-phenyl ester |
| Alternate Name(s) |
3-Cyano-4-(pyrimidin-2-yl)phenyl 4-methylbenzenesulfonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H13N3O3S |
| InChI |
InChI=1S/C18H13N3O3S/c1-13-3-6-16(7-4-13)25(22,23)24-15-5-8-17(14(11-15)12-19)18-20-9-2-10-21-18/h2-11H,1H3 |
| InChIKey |
VCSJJBLVTMLFKN-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/jo500087g |
| Molecular Weight |
351.380 g/mol |
| SMILES |
c1cnc(-c2ccc(OS(c3ccc(cc3)C)(=O)=O)cc2C#N)nc1 |
| SPLASH |
splash10-052f-9302000000-2149ebda64759210d03a |
| Source of Spectrum |
J-79-3233-2g |
| Wiley ID |
1746132 |
