Back ChemicalBook Home>CAS DataBase List>21135-08-0More Spectrum> 5-tert-Butyl-2-chloro-1,3,2-dioxaphosphorinane(21135-08-0) 1H NMR
5-tert-Butyl-2-chloro-1,3,2-dioxaphosphorinane(21135-08-0) 1H NMR
Product Name5-tert-Butyl-2-chloro-1,3,2-dioxaphosphorinane
CAS21135-08-0
Molecular FormulaC7H14ClO2P
Molecular Weight196.61
InChIInChI=1S/C7H14ClO2P/c1-7(2,3)6-4-9-11(8)10-5-6/h6H,4-5H2,1-3H3
InChIKey KOAOQFNMUIMWFU-UHFFFAOYSA-N
SmilesO1CC(C(C)(C)C)COP1Cl
-
Parameter ppm Hz
D(A) 4.55 D(B) 4.25 D(C) 2.17 J(A,A') 0.0 J(A,B) -10.8 J(A,B') 0.0 J(A,C) 11.7 J(A,M) 5.28 J(A',B) 0.0 J(A',B') -10.8 J(A',C) 11.7 J(A',M) 5.28 J(B,B') 0.0 J(B,C) 3.83 J(B,M) 11.3 J(B',C) 3.83 J(B',M) 11.3 J(C,M) 0.0 D(D) 0.93 BENTRUDE,W.G. & HARGIS,J.H. J.AM.CHEM.SOC. 92, 7136 (1970)Spectral Code: 1H NMR : parameter in CDCl3