Acetyl bromide(506-96-7) IR1
Product NameAcetyl bromide
CAS506-96-7
Molecular FormulaC2H3BrO
Molecular Weight122.95
InChIInChI=1S/C2H3BrO/c1-2(3)4/h1H3
InChIKey FXXACINHVKSMDR-UHFFFAOYSA-N
SmilesC(Br)(C)=O
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MassMS-NW-2819 acetyl bromide C2H3BrO (Mass of molecular ion: 122)
Source Temperature: 280 °C Sample Temperature: 180 °C Reservoir, 75 eV
12.0 1.1 13.0 3.2 14.0 12.8 15.0 45.9 25.0 1.8 26.0 2.5 28.0 2.6 29.0 3.9 40.0 1.2 41.0 7.0 42.0 24.5 43.0 100.0 44.0 2.3 45.0 1.2 79.0 14.4 80.0 5.5 81.0 13.8 82.0 5.4 93.0 1.6 94.0 1.0 107.0 1.9 109.0 1.8
parameter in CDCl3
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1H NMR 300 MHz C2 H3 Br O 0.05 ml : 0.5 ml CDCl3 acetyl bromide 
Parameter ppm Hz
D(A) 2.818
Hz ppm Int.845.40 2.818 1000
in CDCl3
liquid film
