| SpectraBase Spectrum ID |
LTlkkihqad6 |
| Name |
XSUWBUQYHYYFEV-UHFFFAOYSA-N |
| Compound Number |
III-3 |
| Copyright |
Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C21H22ClN5OS |
| InChI |
InChI=1S/C21H22ClN5OS/c1-4-5-6-11-24-21-26-18-16(12-23)19(29-3)25-13(2)17(18)20(28)27(21)15-9-7-14(22)8-10-15/h7-10H,4-6,11H2,1-3H3,(H,24,26) |
| InChIKey |
XSUWBUQYHYYFEV-UHFFFAOYSA-N |
| Literature Reference Author |
G.XU,J.SONG,J.HE,Q.REN,W.MO,H.XU,S.SUN,H.HE,Y.CUI |
| Literature Reference Citation |
MAGN.RES.CHEM.,50,646(2012) |
| Literature Reference DOI |
10.1002/mrc.3853 |
| Molecular Weight |
427.952 g/mol |
| Solvent |
CDCl3 |
| Source File Reference |
UWLU82295 |
