Product Name(1E,3Z)-1,4-dichlorobuta-1,3-diene
CAS3588-13-4
Molecular FormulaC4H4Cl2
Molecular Weight122.98
InChIInChI=1S/C4H4Cl2/c5-3-1-2-4-6/h1-4H/b3-1-,4-2+
InChIKey LDZSRRMBFGBOAE-HSFFGMMNSA-N
SmilesC(/Cl)=C\C=C/Cl
Parameter ppm Hz
D(A) 6.032 D(B) 6.252 D(C) 6.884 D(D) 6.375 J(A,B) 7.24 J(A,C) -1.19 J(A,D) 0.76 J(B,C) 10.82 J(B,D) -0.71 J(C,D) 13.34 BOTHNER-BY,A.A. & HARRIS,R.K. J.AM.CHEM.SOC. 87, 3445 (1965)
(1E,3Z)-1,4-dichlorobuta-1,3-diene (3588-13-4) 1H NMR Atlas of Related Products
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