Product Name(1Z,3Z)-1,4-Dicyano-1,3-pentadiene
Molecular FormulaC7H6N2
Molecular Weight118.13594
InChIInChI=1S/C7H6N2/c1-7(6-9)4-2-3-5-8/h2-4H,1H3/b3-2-,7-4-
InChIKey YINBQNJDWJJHOA-JXPISWCDSA-N
SmilesC(/C#N)=C/C=C(\C#N)/C
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Parameter ppm Hz
D(A) 5.55 D(B) 7.20 D(C) 7.08 J(A,B) 11.9 J(A,C) -2.5 J(B,C) 8.7 D(D) 2.17 HALL,J.H. & PATTERSON,E. J.AM.CHEM.SOC. 89, 5856 (1967)Spectral Code: 1H NMR : parameter in CDCl3