| SpectraBase Spectrum ID |
9nMLqVKQFgX |
| Name |
CASIMIROEDINE;MAJOR_ISOMER;SOLVENT-#2 |
| Compound Number |
1 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C21H27N3O6 |
| InChI |
InChI=1S/C21H27N3O6/c1-23(17(26)8-7-14-5-3-2-4-6-14)10-9-15-11-24(13-22-15)21-20(29)19(28)18(27)16(12-25)30-21/h2-8,11,13,16,18-21,25,27-29H,9-10,12H2,1H3/b8-7+ |
| InChIKey |
CSFQQZOIHVWGMN-BQYQJAHWSA-N |
| Literature Reference Author |
W.F.REYNOLDS,R.G.ENRIQUEZ,G.A.MAGOS,D.GNECCO |
| Literature Reference Citation |
MAGN.RES.CHEM.,38,366(2000) |
| Literature Reference DOI |
10.1002/1097-458x(200005)38:5<366::aid-mrc650>3.0.co;2-8 |
| Molecular Weight |
417.462 g/mol |
| Solvent |
CD3OD:DMSO-D6=80:20 |
| Source File Reference |
UWBS1090 |
