SpectraBase Spectrum ID |
1qBJQbXCaKb |
Name |
CBNIFFRLHIYNSS-UHFFFAOYSA-M |
Compound Number |
8 |
Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula |
C32H36BrN7 |
InChI |
InChI=1S/C32H36N7.BrH/c33-31-30-32(35-23-34-31)39(24-36-30)22-28-13-9-26(10-14-28)6-2-1-5-25-7-11-27(12-8-25)21-37-19-15-29(16-20-37)38-17-3-4-18-38;/h7-16,19-20,23-24H,1-6,17-18,21-22H2,(H2,33,34,35);1H/q+1;/p-1 |
InChIKey |
CBNIFFRLHIYNSS-UHFFFAOYSA-M |
Literature Reference Author |
B.RUBIO-RUIZ,A.CONEJO-GARCIA,M.A.GALLO,A.ESPINOSA,A.ENTRENA |
Literature Reference Citation |
MAGN.RES.CHEM.,50,466(2012) |
Literature Reference DOI |
10.1002/mrc.3817 |
Molecular Weight |
598.589 g/mol |
Solvent |
CD3OD |
Source File Reference |
UWBT16077 |