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({8-[(1E)-1-({4-[(6-chloropyrazin-2-yl)sulfamoyl]phenyl}imino)ethyl]-4-methyl-2-oxo-2H-chromen-7-yl}oxy)palladiumol palladiumdiol hydrate
SpectraBase Compound ID EUivfYKqt50
InChI InChI=1S/C22H17ClN4O5S.4H2O.2Pd/c1-12-9-20(29)32-22-16(12)7-8-17(28)21(22)13(2)25-14-3-5-15(6-4-14)33(30,31)27-19-11-24-10-18(23)26-19;;;;;;/h3-11,28H,1-2H3,(H,26,27);4*1H2;;/q;;;;;2*+2/p-4/b25-13+;;;;;;
InChIKey CIARUTLSWCSTPI-PNHACLFMSA-J
Mol Weight 765.78 g/mol
Molecular Formula C22H21ClN4O9Pd2S
Exact Mass 763.878737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7pOpw0Os03v
Name ({8-[(1E)-1-({4-[(6-chloropyrazin-2-yl)sulfamoyl]phenyl}imino)ethyl]-4-methyl-2-oxo-2H-chromen-7-yl}oxy)palladiumol palladiumdiol hydrate
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21ClN4O9Pd2S
InChI InChI=1S/C22H17ClN4O5S.4H2O.2Pd/c1-12-9-20(29)32-22-16(12)7-8-17(28)21(22)13(2)25-14-3-5-15(6-4-14)33(30,31)27-19-11-24-10-18(23)26-19;;;;;;/h3-11,28H,1-2H3,(H,26,27);4*1H2;;/q;;;;;2*+2/p-4/b25-13+;;;;;;
InChIKey CIARUTLSWCSTPI-PNHACLFMSA-J
Instrument Name Shimadzu Q 1000 EX GC-MS
Ionization Type EI
Literature Reference DOI 10.1002/aoc.6840
Molecular Weight 765.784 g/mol
SMILES O.O[Pd]Oc1ccc2c(c1\C(=N\c1ccc(S(Nc3cncc(n3)Cl)(=O)=O)cc1)C)OC(C=C2C)=O.O[Pd]O
SPLASH splash10-0l1i-9321111000-461a2bb159568d0fe5d3
Source of Spectrum AOC-36-14-Pd2-Sb
Wiley ID 1882718