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(nitrooxy)cuprio nitrate N'-[(1E)-1-(thiophen-2-yl)ethylidene]pyridine-4-carbohydrazide dihydrate
SpectraBase Compound ID 7t7eLqldjZV
InChI InChI=1S/C12H11N3OS.Cu.2NO3.2O/c1-9(11-3-2-8-17-11)14-15-12(16)10-4-6-13-7-5-10;;2*2-1(3)4;;/h2-8H,1H3,(H,15,16);;;;;/q;+2;2*-1;;/b14-9+;;;;;
InChIKey RKQSRDLWFAEXGQ-CAFJVWNPSA-N
Mol Weight 464.85 g/mol
Molecular Formula C12H11CuN5O9S
Exact Mass 463.957345 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E6mhqG7k2qp
Name (nitrooxy)cuprio nitrate N'-[(1E)-1-(thiophen-2-yl)ethylidene]pyridine-4-carbohydrazide dihydrate
Appearance Brown crystals
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Formula C12H15CuN5O9S
InChI InChI=1S/C12H11N3OS.Cu.2NO3.2O/c1-9(11-3-2-8-17-11)14-15-12(16)10-4-6-13-7-5-10;;2*2-1(3)4;;/h2-8H,1H3,(H,15,16);;;;;/q;+2;2*-1;;/b14-9+;;;;;
InChIKey RKQSRDLWFAEXGQ-CAFJVWNPSA-N
Instrument Name Hewlett Packard MS 5988
Ionization Type EI
Literature Reference DOI 10.1002/aoc.6697
Molecular Weight 468.884 g/mol
SMILES [Cu](O[N+](=O)[O-])O[N+](=O)[O-].O.O.N(C(c1ccncc1)=O)\N=C/(C)c1sccc1
SPLASH splash10-06vu-6966400000-bb92aa947cada46b294c
Source of Spectrum AOC-36-SM6-6-1
Wiley ID 1870847