2-Bromo-1 4-naphthoquinone 98(2065-37-4) 1H NMR
Molecular FormulaC10H5BrO2
Molecular Weight237.05
InChIInChI=1S/C10H5BrO2/c11-8-5-9(12)6-3-1-2-4-7(6)10(8)13/h1-5H
InChIKey KJOHPBJYGGFYBJ-UHFFFAOYSA-N
SmilesC1(=O)C2=C(C=CC=C2)C(=O)C=C1Br
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Parameter ppm Hz
D(A) 8.109
D(B) 7.775
D(C) 7.791
D(D) 8.027
J(A,B) 7.69
J(A,C) 1.40
J(A,D) 0.59
J(B,C) 7.54
J(B,D) 1.09
J(C,D) 7.89
D(E) 7.551
CRECELY,R.W. ET AL. J.MOL.SPECTROSC. 32, 407 (1969)
Spectral Code: 1H NMR : parameter in THF