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1-OXO-3,5,8-TRIS(TRICHLOROMETHYL)-1,4-DIPHOSPHA-2,6,7-TRIOXABICYCLO[2.2.2]OCTANE
SpectraBase Compound ID 12K1ZedDvtK
InChI InChI=1S/C6H3Cl9O4P2/c7-4(8,9)1-17-21(16)18-2(5(10,11)12)20(1)3(19-21)6(13,14)15/h1-3H/t1-,2-,3-,20?,21-/m1/s1
InChIKey MFPHRSDNDKOJPR-OGWXUGSRSA-N
Mol Weight 520.1 g/mol
Molecular Formula C6H3Cl9O4P2
Exact Mass 515.670332 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KgSTAYvTdcL
Name 1-OXO-3,5,8-TRIS(TRICHLOROMETHYL)-1,4-DIPHOSPHA-2,6,7-TRIOXABICYCLO[2.2.2]OCTANE
Comments , SCALE INVERTED
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Formula C6H3Cl9O4P2
InChI InChI=1S/C6H3Cl9O4P2/c7-4(8,9)1-17-21(16)18-2(5(10,11)12)20(1)3(19-21)6(13,14)15/h1-3H/t1-,2-,3-,20?,21-/m1/s1
InChIKey MFPHRSDNDKOJPR-OGWXUGSRSA-N
Instrument Name Bruker HX-90
Literature Reference E.S.KOZLOV, A.V.SOLOV'EV, L.N.MARKOVSKY (1978) Zhurn.Obsch.Khim.(Russ. Lang.):v.48, N11, 2437-2442.
NMR Standard -H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C4H8O2 ethylacetate