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(Z)-(chlorocobaltio N-[(2E)-1-{N'-[(E)-(2-nitrophenyl)methylidene]hydrazinecarbonyl}propan-2-ylidene]pyridine-4-carbohydrazonate) trihydrate
SpectraBase Compound ID ExEDhFM27Lv
InChI InChI=1S/C17H16N6O4.ClH.Co.3O/c1-12(20-22-17(25)13-6-8-18-9-7-13)10-16(24)21-19-11-14-4-2-3-5-15(14)23(26)27;;;;;/h2-9,11H,10H2,1H3,(H,21,24)(H,22,25);1H;;;;/q;;+2;;;/p-2/b19-11+,20-12+;;;;;
InChIKey XMZHJDJHBHVFAM-KJOLTNBTSA-L
Mol Weight 509.728 g/mol
Molecular Formula C17H15ClCoN6O7
Exact Mass 509.002269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WWAC4oLSVB
Name (Z)-(chlorocobaltio N-[(2E)-1-{N'-[(E)-(2-nitrophenyl)methylidene]hydrazinecarbonyl}propan-2-ylidene]pyridine-4-carbohydrazonate) trihydrate
Appearance Green solid
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Formula C17H21ClCoN6O7
InChI InChI=1S/C17H16N6O4.ClH.Co.3O/c1-12(20-22-17(25)13-6-8-18-9-7-13)10-16(24)21-19-11-14-4-2-3-5-15(14)23(26)27;;;;;/h2-9,11H,10H2,1H3,(H,21,24)(H,22,25);1H;;;;/q;;+2;;;/p-2/b19-11+,20-12+;;;;;
InChIKey XMZHJDJHBHVFAM-KJOLTNBTSA-L
Instrument Name Shimadzu GCMS-Q1000-EX or GCMS 5988-A HP
Ionization Type EI
Literature Reference DOI 10.1002/aoc.6205
Molecular Weight 515.776 g/mol
SMILES O.N(C(C\C(=N\N=C\(c1ccncc1)O[Co]Cl)C)=O)\N=C\c1c([N+](=O)[O-])cccc1.O.O
SPLASH splash10-0100-5556900000-56d2f57975280ddafa9b
Source of Spectrum AOC-35-SM7-2
Wiley ID 1866458