顺,顺-丙二腈(1557-59-1)核磁图(1HNMR)
InChI:InChI=1S/C6H4N2/c7-5-3-1-2-4-6-8/h1-4H/b3-1-,4-2-
InChIKey: QLQYLCRMTTXKHS-CCAGOZQPSA-N
Smiles:C(#N)/C=C\C=C/C#N
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Parameter ppm Hz
D(A) 5.70
D(B) 7.30
J(A,A') 0.6
J(A,B) 11.2
J(A,B') -1.2
J(A',B) -1.2
J(A',B') 11.2
J(B,B') 12.1
HALL,J.H. & PATTERSON,E. J.AM.CHEM.SOC. 89, 5856 (1967)
Spectral Code: 1H NMR : parameter in CDCl3
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Spectral Code: IR : nujol mull