Back ChemicalBook Home>CAS DataBase List>2039-83-0More Spectrum> 3,4-DICHLOROSTYRENE(2039-83-0) 1H NMR
3,4-DICHLOROSTYRENE(2039-83-0) 1H NMR
Product Name3,4-DICHLOROSTYRENE
CAS2039-83-0
Molecular FormulaC8H6Cl2
Molecular Weight173.04
InChIInChI=1S/C8H6Cl2/c1-2-6-3-4-7(9)8(10)5-6/h2-5H,1H2
InChIKey BJQFWAQRPATHTR-UHFFFAOYSA-N
SmilesC1(Cl)=CC=C(C=C)C=C1Cl
parameter in CS2
-
1H NMR 300 MHz C8 H6 Cl2 5 mol% in CS2 3,4-dichlorostyrene 
Parameter ppm Hz
D(A) 7.352 D(B) 7.263 D(C) 7.115 D(D) 6.543 D(E) 5.668 D(F) 5.255 J(A,B) 0.34 J(A,C) 2.07 J(A,D) -0.48 J(A,E) 0.05 J(A,F) 0.18 J(B,C) 8.92 J(B,D) 0.36 J(B,E) 0.05 J(B,F) 0.05 J(C,D) -0.53 J(C,E) 0.05 J(C,F) 0.19 J(D,E) 17.47 J(D,F) 10.84 J(E,F) 0.66 BARFIELD,M. ET AL. J.AM.CHEM.SOC. 93, 4195 (1971) J(A,E) & J(C,E) & J(B,E) & J(B,F)<0.05
Hz ppm Int.2206.64 7.355 779 2204.61 7.349 821 2183.80 7.279 673 2174.91 7.250 1000 2139.45 7.131 489 2137.58 7.125 463 2130.53 7.102 328 2128.66 7.096 311 1977.44 6.591 309 1966.62 6.555 325 1959.95 6.533 353 1949.15 6.497 372 1709.15 5.697 721 1708.57 5.695 728 1691.68 5.639 634 1691.10 5.637 635 1582.08 5.274 669 1581.62 5.272 666 1571.26 5.238 636 1570.80 5.236 632
