SESELIN(523-59-1) 1H NMR
Molecular FormulaC14H12O3
Molecular Weight228.24
InChIInChI=1S/C14H12O3/c1-14(2)8-7-10-11(17-14)5-3-9-4-6-12(15)16-13(9)10/h3-8H,1-2H3
InChIKey QUVCQYQEIOLHFZ-UHFFFAOYSA-N
SmilesC12=CC=C3C=CC(=O)OC3=C1C=CC(C)(C)O2
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Parameter ppm Hz
D(A) 6.08 D(B) 7.50 J(A,B) 9.5 D(C) 7.13 D(D) 6.57 D(E) 5.64 D(F) 6.77 J(C,D) 8.3 J(C,E) 0. J(C,F) 0. J(D,E) 0. J(D,F) 0.65 J(E,F) 10.0 D(G) 1.44 LASSAK,E.V. & PINHEY,J.T. J.CHEM.SOC. C 1967, 2000Spectral Code: 1H NMR : parameter in CDCl3