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DFBASQJGLQIGBZ-UHFFFAOYSA-N

View entire compound with spectra: 3 NMR

DFBASQJGLQIGBZ-UHFFFAOYSA-N
SpectraBase Compound ID IaFZrT8Hb0y
InChI InChI=1S/C26H24P2.2CHF3O3S.CF3.CO.Ir/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;2*2-1(3,4)8(5,6)7;2-1(3)4;1-2;/h1-20H,21-22H2;2*(H,5,6,7);;;
InChIKey DFBASQJGLQIGBZ-UHFFFAOYSA-N
Mol Weight 987.8 g/mol
Molecular Formula C30H26F9IrO7P2S2
Exact Mass 988.008072 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BO5bjtyku5u
Name DFBASQJGLQIGBZ-UHFFFAOYSA-N
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H24F9IrO7P2S2
InChI InChI=1S/C26H24P2.2CHF3O3S.CF3.CO.Ir/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;2*2-1(3,4)8(5,6)7;2-1(3)4;1-2;/h1-20H,21-22H2;2*(H,5,6,7);;;
InChIKey DFBASQJGLQIGBZ-UHFFFAOYSA-N
Literature Reference Author P.J.ALBIETZ,B.P.CLEARY,W.PAW,R.EISENBERG
Literature Reference Citation J.AM.CHEM.SOC.,123,12091(2001)
Literature Reference DOI 10.1021/ja016127l
Molecular Weight 985.790 g/mol
Solvent CD2Cl2
Source File Reference UWSI23998