| SpectraBase Spectrum ID |
D93ex8t0I8N |
| Name |
1-(4-BROMOPHENACYL)-1,4,7,10-TETRAAZACYCLODODECANE-TRINITRIC-ACID-SALT |
| Compound Number |
9 |
| Copyright |
Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C16H28BrN7O10 |
| InChI |
InChI=1S/C16H25BrN4O.3NO3/c17-15-3-1-14(2-4-15)16(22)13-21-11-9-19-7-5-18-6-8-20-10-12-21;3*2-1(3)4/h1-4,18-20H,5-13H2;;;/q;3*-1/p+3 |
| InChIKey |
WWPMRORVPJIUFP-UHFFFAOYSA-Q |
| Literature Reference Author |
E.KIMURA,T.GOTOH,T.KOIKE,M.SHIRO |
| Literature Reference Citation |
J.AM.CHEM.SOC.,121,1267(1999) |
| Literature Reference DOI |
10.1021/ja982904e |
| Molecular Weight |
558.343 g/mol |
| Solvent |
D2O |
| Source File Reference |
UWSI803 |
