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IOQPTEWAALENEA-UHFFFAOYSA-M
SpectraBase Compound ID 6sjXTLozIR0
InChI InChI=1S/C12H19N2O.CHF3O3S.H2O.Pt/c1-13(2)8-10-5-11(9-14(3)4)7-12(15)6-10;2-1(3,4)8(5,6)7;;/h6-7,15H,8-9H2,1-4H3;(H,5,6,7);1H2;/q;;;+1/p-1
InChIKey IOQPTEWAALENEA-UHFFFAOYSA-M
Mol Weight 569.46 g/mol
Molecular Formula C13H21F3N2O5PtS
Exact Mass 569.077121 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4AaX4W5cRL9
Name IOQPTEWAALENEA-UHFFFAOYSA-M
Compound Number 2B*CF3SO3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H21F3N2O5PtS
InChI InChI=1S/C12H19N2O.CHF3O3S.H2O.Pt/c1-13(2)8-10-5-11(9-14(3)4)7-12(15)6-10;2-1(3,4)8(5,6)7;;/h6-7,15H,8-9H2,1-4H3;(H,5,6,7);1H2;/q;;;+1/p-1
InChIKey IOQPTEWAALENEA-UHFFFAOYSA-M
Literature Reference Author M.ALBRECHT,A.L.SPEK,G.V.KOTEN
Literature Reference Citation J.AM.CHEM.SOC.,123,7233(2001)
Literature Reference DOI 10.1021/ja003685b
Molecular Weight 569.455 g/mol
Solvent ACETONE-D6
Source File Reference UWVN27775