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CYCLEN-BIS-BENZHYDROXYSTYRENYL-TRIAZINE_ZINC_(II)_BIS-PERCHLORATE

View entire compound with spectra: 1 NMR

CYCLEN-BIS-BENZHYDROXYSTYRENYL-TRIAZINE_ZINC_(II)_BIS-PERCHLORATE
SpectraBase Compound ID 1dLXnVm9dhp
InChI InChI=1S/C29H34N7O2.2ClHO4.H2O.Zn/c1-3-23-5-9-25(10-6-23)21-37-28-33-27(36-19-17-31-15-13-30-14-16-32-18-20-36)34-29(35-28)38-22-26-11-7-24(4-2)8-12-26;2*2-1(3,4)5;;/h3-12H,1-2,13-22H2;2*(H,2,3,4,5);1H2;/q-3;;;;+5/p-2
InChIKey CTALSRKAQWPBMD-UHFFFAOYSA-L
Mol Weight 794.93 g/mol
Molecular Formula C29H36Cl2N7O11Zn
Exact Mass 792.114127 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4dHPTJIRBLk
Name CYCLEN-BIS-BENZHYDROXYSTYRENYL-TRIAZINE_ZINC_(II)_BIS-PERCHLORATE
Compound Number 6-ZN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H36Cl2N7O11Zn
InChI InChI=1S/C29H34N7O2.2ClHO4.H2O.Zn/c1-3-23-5-9-25(10-6-23)21-37-28-33-27(36-19-17-31-15-13-30-14-16-32-18-20-36)34-29(35-28)38-22-26-11-7-24(4-2)8-12-26;2*2-1(3,4)5;;/h3-12H,1-2,13-22H2;2*(H,2,3,4,5);1H2;/q-3;;;;+5/p-2
InChIKey CTALSRKAQWPBMD-UHFFFAOYSA-L
Literature Reference Author M.SUBAT,A.S.BOROVIK,B.KOENIG
Literature Reference Citation J.AM.CHEM.SOC.,126,3185(2004)
Literature Reference DOI 10.1021/ja038980l
Molecular Weight 794.931 g/mol
Solvent DMSO-D6
Source File Reference UWMZ21734