| SpectraBase Spectrum ID |
5KUAitmbIdv |
| Name |
p-Toluenesulfonate anion 1-p-methylphenyl-1,3-diazadihydroazulanone cation |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H20N2O4S |
| InChI |
InChI=1S/C15H12N2O.C7H8O3S/c1-11-7-9-12(10-8-11)17-14-6-4-2-3-5-13(14)16-15(17)18;1-6-2-4-7(5-3-6)11(8,9)10/h2-10H,1H3;2-5H,1H3,(H,8,9,10) |
| InChIKey |
GZXWYHAPCLNZKY-UHFFFAOYSA-N |
| Molecular Weight |
408.472 g/mol |
| SMILES |
c1(S([O-])(=O)=O)ccc(cc1)C.N1c2ccccc[c+]2N(C1=O)c1ccc(C)cc1 |
| SPLASH |
splash10-00kr-0590000000-bdf12cf5b9c260c7587b |
| Source of Spectrum |
H1-55-2323-2 |
| Wiley ID |
1564779 |
