For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

CIS-DIMETHYL-2,4-BIS-(3-NITROPHENYL)-3,7-DIMETHYL-9-OXO-3,7-DIAZABICYCLO-[3.3.1]-NONANE-1,5-DICARBOXYLATE

View entire compound with spectra: 1 NMR

CIS-DIMETHYL-2,4-BIS-(3-NITROPHENYL)-3,7-DIMETHYL-9-OXO-3,7-DIAZABICYCLO-[3.3.1]-NONANE-1,5-DICARBOXYLATE
SpectraBase Compound ID AuolOsYe78w
InChI InChI=1S/2C25H26N4O9/c2*1-26-13-24(22(31)37-3)19(15-7-5-9-17(11-15)28(33)34)27(2)20(16-8-6-10-18(12-16)29(35)36)25(14-26,21(24)30)23(32)38-4/h2*5-12,19-20H,13-14H2,1-4H3
InChIKey CTRWHIUDCOGHMH-UHFFFAOYSA-N
Mol Weight 1053.0 g/mol
Molecular Formula C50H52N8O18
Exact Mass 1052.339957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BUDMmCdJcq7
Name CIS-DIMETHYL-2,4-BIS-(3-NITROPHENYL)-3,7-DIMETHYL-9-OXO-3,7-DIAZABICYCLO-[3.3.1]-NONANE-1,5-DICARBOXYLATE
Compound Number 3,CIS
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H52N8O18
InChI InChI=1S/2C25H26N4O9/c2*1-26-13-24(22(31)37-3)19(15-7-5-9-17(11-15)28(33)34)27(2)20(16-8-6-10-18(12-16)29(35)36)25(14-26,21(24)30)23(32)38-4/h2*5-12,19-20H,13-14H2,1-4H3
InChIKey CTRWHIUDCOGHMH-UHFFFAOYSA-N
Literature Reference Author T.SIENER,U.HOLZGRABE,S.DROSIHN,W.BRANDT
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1827(1999)
Literature Reference DOI 10.1039/a806641h
Molecular Weight 1053.006 g/mol
Solvent Unknown
Source File Reference UWRU10525