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[1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-yl]dichloro{[2-(2-oxopropoxy)phenyl]methylidene}ruthenium
SpectraBase Compound ID JrSvw29BNUu
InChI InChI=1S/C21H27N2.C10H10O2.2ClH.Ru/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-8-5-3-4-6-10(8)12-7-9(2)11;;;/h9-13H,7-8H2,1-6H3;1,3-6H,7H2,2H3;2*1H;/q;;;;+2/p-2
InChIKey AJWQXGXJUHDCBS-UHFFFAOYSA-L
Mol Weight 641.6 g/mol
Molecular Formula C31H37Cl2N2O2Ru
Exact Mass 641.127549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Wszc0AusbU
Name [1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-yl]dichloro{[2-(2-oxopropoxy)phenyl]methylidene}ruthenium
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Formula C31H37Cl2N2O2Ru
InChI InChI=1S/C21H27N2.C10H10O2.2ClH.Ru/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-8-5-3-4-6-10(8)12-7-9(2)11;;;/h9-13H,7-8H2,1-6H3;1,3-6H,7H2,2H3;2*1H;/q;;;;+2/p-2
InChIKey AJWQXGXJUHDCBS-UHFFFAOYSA-L
Instrument Name LRMS
Ionization Type EI
Molecular Weight 641.627 g/mol
SMILES c1(cc(cc(c1N1CCN(C1[Ru](=Cc1c(OCC(=O)C)cccc1)(Cl)Cl)c1c(cc(cc1C)C)C)C)C)C
SPLASH splash10-014r-8901000000-0bd79dce26eff834c693
Source of Spectrum US8536344B2
Wiley ID 1847818