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({1-[2-(4-methylphenyl)diazen-1-yl]-1-{[N'-(phenylamino)-N-(phenylimino)carbamimidoyl]sulfanyl}prop-1-en-2-yl}oxy)cobaltio acetate
SpectraBase Compound ID 7Fm1WTJfLXY
InChI InChI=1S/C23H22N6OS.C2H4O2.Co/c1-17-13-15-21(16-14-17)24-27-22(18(2)30)31-23(28-25-19-9-5-3-6-10-19)29-26-20-11-7-4-8-12-20;1-2(3)4;/h3-16,25,30H,1-2H3;1H3,(H,3,4);/q;;+2/p-2
InChIKey PNMCYGIEMBBVNW-UHFFFAOYSA-L
Mol Weight 547.5 g/mol
Molecular Formula C25H24CoN6O3S
Exact Mass 547.096254 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Y1dHBQkwgf
Name ({1-[2-(4-methylphenyl)diazen-1-yl]-1-{[N'-(phenylamino)-N-(phenylimino)carbamimidoyl]sulfanyl}prop-1-en-2-yl}oxy)cobaltio acetate
Appearance Deep red
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Formula C25H24CoN6O3S
InChI InChI=1S/C23H22N6OS.C2H4O2.Co/c1-17-13-15-21(16-14-17)24-27-22(18(2)30)31-23(28-25-19-9-5-3-6-10-19)29-26-20-11-7-4-8-12-20;1-2(3)4;/h3-16,25,30H,1-2H3;1H3,(H,3,4);/q;;+2/p-2
InChIKey PNMCYGIEMBBVNW-UHFFFAOYSA-L
Instrument Name Shimadzu-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/aoc.5886
Molecular Weight 547.499 g/mol
SMILES N(N=C(SC(=C(C)O[Co]OC(C)=O)N=Nc1ccc(cc1)C)N=Nc1ccccc1)c1ccccc1
SPLASH splash10-0r01-3941110000-11c120bd665b85ca2660
Source of Spectrum AOC-34-8-Co(II)-3b
Wiley ID 1855711