2-Bromo-4-fluoroanisole(452-08-4) 1H NMR
Product Name2-Bromo-4-fluoroanisole
CAS452-08-4
Molecular FormulaC7H6BrFO
Molecular Weight205.02
InChIInChI=1S/C7H6BrFO/c1-10-7-3-2-5(9)4-6(7)8/h2-4H,1H3
InChIKey JIQXVIJARQLCOY-UHFFFAOYSA-N
SmilesC1(OC)=CC=C(F)C=C1Br
-
MassMS-IW-9270 2-bromo-4-fluoroanisole C7H6BrFO (Mass of molecular ion: 204)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 1.3 28.0 2.9 29.0 1.1 31.0 4.5 37.0 1.8 38.0 1.8 50.0 6.2 51.0 2.1 53.0 1.8 55.0 1.8 56.0 4.7 57.0 6.3 61.0 3.6 62.0 3.8 63.0 6.7 68.0 3.4 69.0 1.7 73.0 1.1 74.0 4.1 75.0 9.1 80.0 1.6 81.0 13.4 82.0 14.2 83.0 2.4 92.0 1.0 93.0 3.3 94.0 13.4 95.0 10.8 96.0 3.4 97.0 2.2 110.0 10.2 111.0 4.4 113.0 2.4 125.0 1.0 126.0 2.4 135.0 2.0 137.0 2.1 161.0 44.4 162.0 2.9 163.0 43.8 164.0 2.3 173.0 2.7 175.0 3.0 189.0 60.1 190.0 4.5 191.0 58.6 192.0 4.0 204.0 100.0 205.0 8.0 206.0 97.4 207.0 7.5
400 MHz in CDCl3
-
1H NMR 399.65 MHz C7 H6 Br F O 0.05 ml : 0.5 ml CDCl3 2-bromo-4-fluoroanisole 
Assign. Shift(ppm)
A 7.275 B 6.966 C 6.810 D 3.837
Hz ppm Int.2912.96 7.289 167 2909.91 7.282 178 2905.15 7.270 173 2902.10 7.262 177 2794.31 6.992 96 2791.26 6.985 92 2786.50 6.973 107 2785.28 6.970 123 2783.45 6.965 100 2782.23 6.962 119 2777.47 6.950 122 2774.41 6.943 117 2728.03 6.827 142 2723.27 6.815 144 2718.87 6.804 109 2714.23 6.792 109 1533.94 3.839 1000
in CDCl3
liquid film
