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1-CHLORO-5-FLUORO-2,4-DINITROBENZENE(327-91-3) 1H NMR
Product Name1-CHLORO-5-FLUORO-2,4-DINITROBENZENE
CAS327-91-3
Molecular FormulaC6H2ClFN2O4
Molecular Weight220.54
InChIInChI=1S/C6H2ClFN2O4/c7-3-1-4(8)6(10(13)14)2-5(3)9(11)12/h1-2H
InChIKey RXVKLMKODREOIW-UHFFFAOYSA-N
SmilesC1(Cl)=CC(F)=C([N+]([O-])=O)C=C1[N+]([O-])=O
parameter in benzene
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1H NMR 300 MHz C6 H2 Cl F N2 O4 5 mol% in benzene 1-chloro-5-fluoro-2,4-dinitrobenzene 
Parameter ppm Hz
D(A) 6.103 D(B) 7.754 J(A,B) 0.45 J(A,X) 9.84 J(B,X) 7.13 HUTTON,H.M. ET AL. CAN.J.CHEM. 45, 1796 (1967)
Hz ppm Int.2329.68 7.766 984 2322.57 7.742 1000 1835.92 6.120 982 1826.06 6.087 998