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benzo(b)phenazine N-oxide(30478-16-1) 1H NMR
Product Namebenzo(b)phenazine N-oxide
CAS30478-16-1
Molecular FormulaC16H10N2O
Molecular Weight246.2634
InChIInChI=1S/C16H10N2O/c19-18-15-8-4-3-7-13(15)17-14-9-11-5-1-2-6-12(11)10-16(14)18/h1-10H
InChIKey HOVDLPNLDKGAKU-UHFFFAOYSA-N
SmilesC1C2=C([N+]([O-])=C3C(=N2)C=CC=C3)C=C2C=CC=CC=12
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Parameter ppm Hz
D(A) 9.212 D(B) 8.071 D(C) 7.524 D(D) 7.510 D(E) 8.039 D(F) 8.807 J(A,B) 0.4 J(A,C) 0.0 J(A,D) 0.0 J(A,E) 0.8 J(A,F) 1.2 J(B,C) 8.52 J(B,D) 1.35 J(B,E) 0.83 J(B,F) 0.0 J(C,D) 6.65 J(C,E) 0.91 J(C,F) 0.0 J(D,E) 9.05 J(D,F) 0.0 J(E,F) 0.0 D(G) 8.641 D(I) 7.667 D(J) 7.741 D(K) 8.155 J(G,I) 9.24 J(G,J) 1.20 J(G,K) 0.76 J(I,J) 6.54 J(I,K) 1.36 J(J,K) 9.00 LIMBACH,H.H. ET AL. BER.BUNSENGES.PHYS.CHEM. 74, 966 (1970)Spectral Code: 1H NMR : parameter in CDCl3