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4'-[N-(6-CHLORO-2-METHOXYACRIDINE-9-AMINOETHANETHIO)]-2,2':6',2''-TERPYRIDINE-PLATINUM-(II)-2-HYDROXYETHANETHIOLATE
SpectraBase Compound ID 2wXp5enqVsC
InChI InChI=1S/C31H24ClN5OS.C2H6OS.2NO3.Pt/c1-38-21-9-11-25-24(17-21)31(23-10-8-20(32)16-28(23)36-25)35-14-15-39-22-18-29(26-6-2-4-12-33-26)37-30(19-22)27-7-3-5-13-34-27;3-1-2-4;2*2-1(3)4;/h2-13,16-19H,14-15H2,1H3,(H,35,36);3-4H,1-2H2;;;/q;;2*-1;+2
InChIKey XPYDGZXSSYGCLT-UHFFFAOYSA-N
Mol Weight 947.302 g/mol
Molecular Formula C33H30ClN7O8PtS2
Exact Mass 946.093375 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9gpqvoUDZGq
Name 4'-[N-(6-CHLORO-2-METHOXYACRIDINE-9-AMINOETHANETHIO)]-2,2':6',2''-TERPYRIDINE-PLATINUM-(II)-2-HYDROXYETHANETHIOLATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H30ClN7O8PtS2
InChI InChI=1S/C31H24ClN5OS.C2H6OS.2NO3.Pt/c1-38-21-9-11-25-24(17-21)31(23-10-8-20(32)16-28(23)36-25)35-14-15-39-22-18-29(26-6-2-4-12-33-26)37-30(19-22)27-7-3-5-13-34-27;3-1-2-4;2*2-1(3)4;/h2-13,16-19H,14-15H2,1H3,(H,35,36);3-4H,1-2H2;;;/q;;2*-1;+2
InChIKey XPYDGZXSSYGCLT-UHFFFAOYSA-N
Literature Reference Author O.INHOFF,J.M.RICHARDS,J.W.BRIET,G.LOWE,R.L.KRAUTH-SIEGEL
Literature Reference Citation J.MED.CHEM.,45,4524(2002)
Literature Reference DOI 10.1021/jm020885k
Molecular Weight 947.296 g/mol
Sample ID 65093
Solvent DMSO-D6