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WPTYHJHNULTMGF-RALZZILFSA-L

View entire compound with spectra: 1 NMR

WPTYHJHNULTMGF-RALZZILFSA-L
SpectraBase Compound ID 5WbCFIRFI06
InChI InChI=1S/C58H40N2O2.2Fe.Zn/c61-55-37-35-51(47(31-27-43-15-7-8-16-43)32-28-44-17-9-10-18-44)39-53(55)41-59-57(49-23-3-1-4-24-49)58(50-25-5-2-6-26-50)60-42-54-40-52(36-38-56(54)62)48(33-29-45-19-11-12-20-45)34-30-46-21-13-14-22-46;;;/h1-6,23-26,35-42,47-48,57-58,61-62H,27-34H2;;;/q;;;+2/p-2/t57-,58-;;;/m1.../s1
InChIKey WPTYHJHNULTMGF-RALZZILFSA-L
Mol Weight 972.0 g/mol
Molecular Formula C58H38Fe2N2O2Zn
Exact Mass 970.092342 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7IOuRgheF1g
Name WPTYHJHNULTMGF-RALZZILFSA-L
Compound Number (-)-#12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C58H38Fe2N2O2Zn
InChI InChI=1S/C58H40N2O2.2Fe.Zn/c61-55-37-35-51(47(31-27-43-15-7-8-16-43)32-28-44-17-9-10-18-44)39-53(55)41-59-57(49-23-3-1-4-24-49)58(50-25-5-2-6-26-50)60-42-54-40-52(36-38-56(54)62)48(33-29-45-19-11-12-20-45)34-30-46-21-13-14-22-46;;;/h1-6,23-26,35-42,47-48,57-58,61-62H,27-34H2;;;/q;;;+2/p-2/t57-,58-;;;/m1.../s1
InChIKey WPTYHJHNULTMGF-RALZZILFSA-L
Literature Reference Author A.PATTI,S.PEDOTTI,F.P.BALLISTRERI,G.T.SFRAZZETTO
Literature Reference Citation MOLECULES,14,4312(2009)
Literature Reference DOI 10.3390/molecules14114312
Molecular Weight 972.026 g/mol
Sample ID 69870
Solvent DMSO-D6