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Back ChemicalBook Home>CAS DataBase List>66-97-7More Spectrum> Psoralen(66-97-7) 1H NMR

66-97-7

Psoralen(66-97-7) 1H NMR

Product NamePsoralen

CAS66-97-7

Molecular FormulaC11H6O3

Molecular Weight186.16

InChIInChI=1S/C11H6O3/c12-11-2-1-7-5-8-3-4-13-9(8)6-10(7)14-11/h1-6H

InChIKey ZCCUUQDIBDJBTK-UHFFFAOYSA-N

SmilesC1(=O)OC2=CC3OC=CC=3C=C2C=C1

  • Psoralen(66-97-7) <sup>1</sup>H NMR


        Parameter     ppm  Hz
    D(A) 6.36 D(B) 7.78 D(C) 7.67 D(D) 6.82 D(E) 7.68 D(F) 7.46 J(A,B) 9.65 J(A,C) 0.30 J(A,D) 0.0 J(A,E) 0.0 J(A,F) 0.0 J(B,C) 0.35 J(B,D) 0.0 J(B,E) 0.0 J(B,F) 0.65 J(C,D) 0.20 J(C,E) 0.0 J(C,F) 0.5 J(D,E) 2.30 J(D,F) 1.00 J(E,F) 0.0 JARVIS,M.W. & MORITZ,A.G. AUST.J.CHEM. 21, 2445 (1968)
    Spectral Code: 1H NMR : parameter in CDCl3

Psoralen(66-97-7) 1H NMR Atlas of Related Products

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