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4-METHYL-4-(D3-METHYL)-4-PHOSPHONIATETRACYCLO-[3.3.0.0(2,8).0(3,6)]-OCTANE-BROMIDE
SpectraBase Compound ID 1lOZA4RWw7z
InChI InChI=1S/C9H14P.BrH/c1-10(2)8-5-3-4-6(8)7(4)9(5)10;/h4-9H,3H2,1-2H3;1H/q+1;/p-1/t4?,5-,6-,7+,8-,9+;/i1D3;/t4?,5-,6-,7+,8-,9+,10+;
InChIKey WNSCXYPNOMIERL-PVVJEAJPSA-M
Mol Weight 236.11 g/mol
Molecular Formula C9H112H3BrP
Exact Mass 235.020481 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D6W1HNGz7fj
Name 4-METHYL-4-(D3-METHYL)-4-PHOSPHONIATETRACYCLO-[3.3.0.0(2,8).0(3,6)]-OCTANE-BROMIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H112H3BrP
InChI InChI=1S/C9H14P.BrH/c1-10(2)8-5-3-4-6(8)7(4)9(5)10;/h4-9H,3H2,1-2H3;1H/q+1;/p-1/t4?,5-,6-,7+,8-,9+;/i1D3;/t4?,5-,6-,7+,8-,9+,10+;
InChIKey WNSCXYPNOMIERL-PVVJEAJPSA-M
Literature Reference Author S.E.CREMER,J.M.COWLES,F.R.FARR,H.O.HWANG,P.W.KREMER,A.C.PETE RSON,G.A.GRAY
Literature Reference Citation J.ORG.CHEM.,57,511(1992)
Literature Reference DOI 10.1021/jo00028a022
Molecular Weight 236.106 g/mol
Solvent CDCl3
Source File Reference UWCS2031