DIBROMOACETONITRILE(3252-43-5) MS
Product NameDIBROMOACETONITRILE
CAS3252-43-5
Molecular FormulaC2HBr2N
Molecular Weight198.84
InChIInChI=1S/C2HBr2N/c3-2(4)1-5/h2H
InChIKey NDSBDLSWTGLNQA-UHFFFAOYSA-N
SmilesC(#N)C(Br)Br
-
MassMS-NW-7795 dibromoacetonitrile C2HBr2N (Mass of molecular ion: 197)
Source Temperature: 240 °C Sample Temperature: 150 °C Reservoir, 75 eV
12.0 3.0 25.0 1.1 26.0 1.1 28.0 1.2 38.0 6.0 39.0 10.8 40.0 6.6 44.0 5.3 74.0 1.2 79.0 12.0 80.0 2.6 81.0 11.7 82.0 2.5 91.0 12.1 92.0 1.4 93.0 12.2 94.0 1.5 117.0 2.9 118.0 100.0 119.0 8.5 120.0 98.0 121.0 5.9 160.0 1.5 196.0 2.3 197.0 18.4 198.0 4.8 199.0 35.2 200.0 3.2 201.0 17.4
parameter in CDCl3
-
1H NMR 300 MHz C2 H Br2 N 0.05 ml : 0.5 ml CDCl3 dibromoacetonitrile 
Parameter ppm Hz
D(A) 5.827
Hz ppm Int.1748.10 5.827 1000
in CDCl3
liquid film
