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[(6-{[(2-{[(7-hydroxy-5-methoxy-2-methyl-4-oxo-4H-chromen-6-yl)methylidene]amino}phenyl)imino]methyl}-5-methoxy-2-methyl-4-oxo-4H-chromen-7-yl)oxy]nickelol hexahydrate
SpectraBase Compound ID H3WDL8KEzEl
InChI InChI=1S/C30H24N2O8.Ni.7H2O/c1-15-9-23(35)27-25(39-15)11-21(33)17(29(27)37-3)13-31-19-7-5-6-8-20(19)32-14-18-22(34)12-26-28(30(18)38-4)24(36)10-16(2)40-26;;;;;;;;/h5-14,33-34H,1-4H3;;7*1H2/q;+2;;;;;;;/p-2
InChIKey AVZOPUGAXSBGMM-UHFFFAOYSA-L
Mol Weight 723.31 g/mol
Molecular Formula C30H36N2NiO15
Exact Mass 722.14691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EmhvrCF33wb
Name [(6-{[(2-{[(7-hydroxy-5-methoxy-2-methyl-4-oxo-4H-chromen-6-yl)methylidene]amino}phenyl)imino]methyl}-5-methoxy-2-methyl-4-oxo-4H-chromen-7-yl)oxy]nickelol hexahydrate
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Formula C30H36N2NiO15
InChI InChI=1S/C30H24N2O8.Ni.7H2O/c1-15-9-23(35)27-25(39-15)11-21(33)17(29(27)37-3)13-31-19-7-5-6-8-20(19)32-14-18-22(34)12-26-28(30(18)38-4)24(36)10-16(2)40-26;;;;;;;;/h5-14,33-34H,1-4H3;;7*1H2/q;+2;;;;;;;/p-2
InChIKey AVZOPUGAXSBGMM-UHFFFAOYSA-L
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2015.07.008
Molecular Weight 723.310 g/mol
SMILES O.O[Ni]Oc1cc2c(c(c1C=Nc1c(N=Cc3c(cc4c(c3OC)C(C=C(O4)C)=O)O)cccc1)OC)C(C=C(O2)C)=O.O.O.O.O.O
SPLASH splash10-01qi-1159687200-dcc0c3630d1d73323e83
Source of Spectrum AJC-11-703-Ni-HL
Wiley ID 1857248