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TZZBWUFDGORPRX-UHFFFAOYSA-L

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TZZBWUFDGORPRX-UHFFFAOYSA-L
SpectraBase Compound ID DsIvEmziYCX
InChI InChI=1S/2C11H9NO3.C11H8NO3.2Mg.4H2O.O/c3*1-6(13)9-10(14)7-4-2-3-5-8(7)12-11(9)15;;;;;;;/h2*2-5H,1H3,(H2,12,14,15);2-5H,1H3,(H,12,15);;;4*1H2;/q;;;2*+1;;;;;/p-2
InChIKey TZZBWUFDGORPRX-UHFFFAOYSA-L
Mol Weight 743.2 g/mol
Molecular Formula C33H32Mg2N3O14
Exact Mass 742.158511 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7HVtSmdDgfD
Name TZZBWUFDGORPRX-UHFFFAOYSA-L
CAS Registry Number 620945-14-4
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H32Mg2N3O14
InChI InChI=1S/2C11H9NO3.C11H8NO3.2Mg.4H2O.O/c3*1-6(13)9-10(14)7-4-2-3-5-8(7)12-11(9)15;;;;;;;/h2*2-5H,1H3,(H2,12,14,15);2-5H,1H3,(H,12,15);;;4*1H2;/q;;;2*+1;;;;;/p-2
InChIKey TZZBWUFDGORPRX-UHFFFAOYSA-L
Literature Reference Author G.ATHANASELLIS,E.GAVRIELATOS,O.IGGLESSI-MARKOPOULOU,J.MARKOP OULOS
Literature Reference Citation J.HETCYCL.CHEM.,40,645(2003)
Literature Reference DOI 10.1002/jhet.5570400413
Molecular Weight 743.239 g/mol
Solvent DMSO-D6
Source File Reference UWMS22652