4-Fluoro-2-methylaniline(452-71-1)IR
Product Name4-Fluoro-2-methylaniline
CAS452-71-1
Molecular FormulaC7H8FN
Molecular Weight125.14
InChIInChI=1S/C7H8FN/c1-5-4-6(8)2-3-7(5)9/h2-4H,9H2,1H3
InChIKey KMHLGVTVACLEJE-UHFFFAOYSA-N
SmilesC1(N)=CC=C(F)C=C1C
parameter in CCl4
-
1H NMR 300 MHz C7 H8 F N 10 mol% in CCl4 4-fluoro-o-toluidine 
Parameter ppm Hz
D(A) 2.06 D(B) 6.65 D(C) 6.60 D(D) 6.41 J(A,B) -0.72 J(A,C) -0.55 J(A,D) 0.0 J(A,X) 0.0 J(B,C) 2.87 J(B,D) 0.42 J(B,X) 9.20 J(C,D) 8.59 J(C,X) 8.20 J(D,X) 4.71 D(E) 3.29 AKSNES,D. &.KRONHAUG,F.H. ACTA CHEM.SCAND. 25, 1871 (1971)
Hz ppm Int.2001.18 6.671 52 1998.33 6.661 74 1991.70 6.639 61 1989.54 6.632 94 1981.70 6.606 78 1978.85 6.596 67 1973.47 6.578 49 1973.08 6.577 49 1970.62 6.569 36 1970.19 6.567 36 1929.47 6.432 100 1929.17 6.431 100 1924.69 6.416 126 1920.94 6.403 78 1915.98 6.387 92 986.99 3.290 1000 618.05 2.060 903
