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2-BROMO-1 4-NAPHTHOQUINONE 98(2065-37-4) 1H NMR
Product Name2-BROMO-1 4-NAPHTHOQUINONE 98
CAS2065-37-4
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