3-Chlorothietane
Product Name
3-Chlorothietane
CAS6013-95-2
MFC3H5ClS
MW108.59
InChIInChI=1S/C3H5ClS/c4-3-1-5-2-3/h3H,1-2H2
InChIKeyXCXWYBUEHDEIQV-UHFFFAOYSA-N
SmilesS1CC(Cl)C1
More
Pack up
-
Parameter ppm Hz
D(A) 5.146
D(B) 3.664
D(C) 3.317
J(A,B) 9.34
J(A,B') 9.34
J(A,C) 7.67
J(A,C') 7.67
J(B,B') -0.48
J(B,C) -8.63
J(B,C') -0.75
J(B',C) -0.75
J(B',C') -8.63
J(C,C') 3.12
KELLER,W.D. ET AL. J.CHEM.PHYS. 44, 782 (1966)
Spectral Code: 1H NMR : parameter neat