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6,6-DICHLORO-1-METHYL-3-(2,4,6-TRIISOPROPYLPHENYL)-3-PHOSPHABICYCLO-[3.1.0]-HEXANE-3-OXIDE
SpectraBase Compound ID 427UXfHLYiJ
InChI InChI=1S/C21H31Cl2OP/c1-12(2)15-8-16(13(3)4)19(17(9-15)14(5)6)25(24)10-18-20(7,11-25)21(18,22)23/h8-9,12-14,18H,10-11H2,1-7H3/t18-,20+,25-/m0/s1
InChIKey PKOMNWPTRSMZCM-NNPDTBDGSA-N
Mol Weight 401.36 g/mol
Molecular Formula C21H31Cl2OP
Exact Mass 400.148958 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ch51xjOixBh
Name 6,6-DICHLORO-1-METHYL-3-(2,4,6-TRIISOPROPYLPHENYL)-3-PHOSPHABICYCLO-[3.1.0]-HEXANE-3-OXIDE
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H31Cl2OP
InChI InChI=1S/C21H31Cl2OP/c1-12(2)15-8-16(13(3)4)19(17(9-15)14(5)6)25(24)10-18-20(7,11-25)21(18,22)23/h8-9,12-14,18H,10-11H2,1-7H3/t18-,20+,25-/m0/s1
InChIKey PKOMNWPTRSMZCM-NNPDTBDGSA-N
Literature Reference Author G.KEGLEVICH,G.M.KESERU,H.FORINTOS,A.SZOELLOSY,K.LADUNYI,L.TO KE
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1801(1999)
Literature Reference DOI 10.1039/a902736j
Solvent CDCl3
Source File Reference UWGE3499