3-Bromo-5-chlorosalicylaldehyde(19652-32-5) IR2
Product Name3-Bromo-5-chlorosalicylaldehyde
CAS19652-32-5
Molecular FormulaC7H4BrClO2
Molecular Weight235.46
InChIInChI=1S/C7H4BrClO2/c8-6-2-5(9)1-4(3-10)7(6)11/h1-3,11H
InChIKey KNOYZLVIXXBBIB-UHFFFAOYSA-N
SmilesC(=O)C1=CC(Cl)=CC(Br)=C1O
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MassMS-KW-0092 3-bromo-5-chlorosalicylaldehyde C7H4BrClO2 (Mass of molecular ion: 234)
Source Temperature: 120 °C Sample Temperature: 100 °C Direct, 75 eV
17.0 1.7 18.0 8.5 28.0 1.8 29.0 2.7 37.0 3.0 38.0 2.5 39.0 2.1 49.0 2.4 50.0 2.1 53.0 4.6 60.0 1.2 61.0 5.9 62.0 9.9 63.0 19.7 64.0 2.8 66.0 1.0 71.0 1.2 72.0 2.2 73.0 5.4 74.0 3.3 75.0 2.2 85.0 2.1 86.0 1.8 90.0 1.4 91.0 2.2 97.0 4.7 98.0 4.0 99.0 7.5 100.0 1.7 101.0 2.2 103.0 2.7 104.0 3.4 105.0 1.0 109.0 4.8 111.0 1.5 117.0 3.3 118.0 3.4 119.0 1.6 125.0 1.2 126.0 14.8 127.0 2.0 128.0 5.1 137.0 1.1 143.0 1.0 153.0 1.2 177.0 5.5 179.0 7.2 181.0 1.8 188.0 5.8 190.0 7.5 192.0 1.9 205.0 1.2 206.0 3.3 207.0 1.8 208.0 3.4 216.0 8.2 218.0 10.7 219.0 1.0 220.0 2.6 233.0 43.3 234.0 78.7 235.0 62.2 236.0 100.0 237.0 21.1 238.0 24.4 239.0 2.0
400 MHz in CDCl3
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1H NMR 399.65 MHz C7 H4 Br Cl O2 0.039 g : 0.5 ml CDCl3 3-bromo-5-chlorosalicylaldehyde 
Assign. Shift(ppm)
A 11.5 B 9.821 C 7.766 D 7.535
Hz ppm Int.4591.80 11.490 670 3925.07 9.822 1000 3922.69 9.816 24 3105.22 7.770 361 3102.84 7.764 378 3016.20 7.548 22 3012.91 7.539 506 3010.52 7.533 486
in CDCl3
KBr disk
Nujol
