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3-BROMO-1,1,1-TRIFLUOROPROPANE(460-32-2) 1H NMR
Product Name3-BROMO-1,1,1-TRIFLUOROPROPANE
CAS460-32-2
Molecular FormulaC3H4BrF3
Molecular Weight176.96
InChIInChI=1S/C3H4BrF3/c4-2-1-3(5,6)7/h1-2H2
InChIKey SAUGMJLWYLQPEM-UHFFFAOYSA-N
SmilesC(F)(F)(F)CCBr
-
Parameter ppm Hz
D(A) 3.351 D(B) 2.603 J(A,A') -10.6 J(A,B) 10.3 J(A,B') 5.9 J(A,X) -0.2 J(A',B) 5.9 J(A',B') 10.3 J(A',X) -0.2 J(B,B') -14.8 J(B,X) 9.8 J(B',X) 9.8 BODOT,H. ET AL. BULL.SOC.CHIM.FR. 1968, 251 J(B,B'):ASSUMED.Spectral Code: 1H NMR : parameter in CS2
