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{4-amino-2-carboxy-6-[(1E)-2-(pyrimidin-2-yl)diazen-1-yl]phenoxy}(chloro)copper hydrate
SpectraBase Compound ID 48EXJzzDyUj
InChI InChI=1S/C11H9N5O3.ClH.Cu.H2O/c12-6-4-7(10(18)19)9(17)8(5-6)15-16-11-13-2-1-3-14-11;;;/h1-5,17H,12H2,(H,18,19);1H;;1H2/q;;+2;/p-2/b16-15+;;;
InChIKey CFFPIJGSEIFHQM-MOJNZBSRSA-L
Mol Weight 375.231 g/mol
Molecular Formula C11H10ClCuN5O4
Exact Mass 373.971729 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DK4cNlxGRUL
Name {4-amino-2-carboxy-6-[(1E)-2-(pyrimidin-2-yl)diazen-1-yl]phenoxy}(chloro)copper hydrate
Appearance Dark brown solid
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Formula C11H10ClCuN5O4
InChI InChI=1S/C11H9N5O3.ClH.Cu.H2O/c12-6-4-7(10(18)19)9(17)8(5-6)15-16-11-13-2-1-3-14-11;;;/h1-5,17H,12H2,(H,18,19);1H;;1H2/q;;+2;/p-2/b16-15+;;;
InChIKey CFFPIJGSEIFHQM-MOJNZBSRSA-L
Instrument Name Finnigan MAT 8222
Ionization Type EI
Literature Reference DOI 10.1002/aoc.6290
Molecular Weight 375.231 g/mol
SMILES Nc1cc(C(O)=O)c(c(c1)\N=N\c1ncccn1)O[Cu]Cl.O
SPLASH splash10-0089-0249000000-8b5df2504bf02fe58418
Source of Spectrum AOC-35-SM5-Cu2+ complex
Wiley ID 1868675