2-Bromoethylbenzene(1973-22-4) 1H NMR
Product Name2-Bromoethylbenzene
CAS1973-22-4
Molecular FormulaC8H9Br
Molecular Weight185.06
InChIInChI=1S/C8H9Br/c1-2-7-5-3-4-6-8(7)9/h3-6H,2H2,1H3
InChIKey HVRUGFJYCAFAAN-UHFFFAOYSA-N
SmilesC1(Br)=CC=CC=C1CC
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MassMS-NW-9938 1-bromo-2-ethylbenzene C8H9Br (Mass of molecular ion: 184)
Source Temperature: 200 °C Sample Temperature: 160 °C Reservoir, 75 eV
27.0 4.5 38.0 2.5 39.0 8.6 49.0 1.0 50.0 9.7 51.0 24.9 51.5 1.3 52.0 6.9 53.0 2.1 61.0 1.3 62.0 3.8 63.0 10.2 64.0 2.4 65.0 2.1 74.0 4.5 75.0 5.8 76.0 4.5 77.0 29.9 78.0 10.1 79.0 12.9 89.0 15.0 90.0 22.6 91.0 3.0 101.0 1.3 102.0 4.5 103.0 16.2 104.0 12.2 105.0 100.0 106.0 8.9 107.0 17.0 108.0 1.3 122.0 7.2 169.0 85.6 170.0 6.6 171.0 83.6 172.0 6.5 184.0 62.6 185.0 6.2 186.0 60.9 187.0 5.4
400 MHz in CDCl3
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1H NMR 399.65 MHz C8 H9 Br 0.05 ml : 0.5 ml CDCl3 1-bromo-2-ethylbenzene 
Assign. Shift(ppm)
A 7.494 B 7.19 C 7.002 D 2.734 E 1.206
Hz ppm Int.3000.12 7.507 127 2999.51 7.506 147 2991.82 7.487 200 2990.97 7.484 135 2879.64 7.206 172 2878.54 7.203 205 2877.08 7.200 217 2874.02 7.192 425 2873.17 7.190 495 2869.87 7.181 42 2869.51 7.181 43 2807.13 7.024 86 2803.59 7.016 95 2802.25 7.012 47 2801.51 7.010 71 2800.90 7.009 49 2799.19 7.005 89 2798.71 7.003 78 2798.10 7.002 84 2795.29 6.995 91 2794.56 6.993 54 2793.82 6.991 69 2793.21 6.990 45 2790.04 6.982 66 1104.25 2.764 115 1096.68 2.745 339 1089.11 2.726 354 1081.67 2.707 132 489.62 1.226 546 482.06 1.207 1000 474.49 1.188 567 472.17 1.182 35
in CDCl3
liquid film
