ACETONITRILE-D3(2206-26-0) MS
Product NameACETONITRILE-D3
CAS2206-26-0
Molecular FormulaC2D3N
Molecular Weight44.07
InChIInChI=1S/C2H3N/c1-2-3/h1H3/i1D3
InChIKey WEVYAHXRMPXWCK-FIBGUPNXSA-N
SmilesC([2H])([2H])([2H])C#N
-
MassMS2008-03702CW acetonitrile-d3 C2D3N (Mass of molecular ion: 44)
Source Temperature: 250 °C Sample Temperature: 200 °C Reservoir, 70 eV
16.0 2.9 26.0 2.2 28.0 3.2 30.0 2.5 38.0 7.5 40.0 14.5 41.0 1.2 42.0 46.4 43.0 4.0 44.0 100.0 45.0 2.5
400 MHz neat
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1H NMR 399.65 MHz C2 D3 N neat acetonitrile-d3 
Assign. Shift(ppm)
A 1.940 J(H,D)=2.4HZ
Hz ppm Int.782.96 1.960 24 780.52 1.954 344 778.08 1.947 700 775.63 1.941 1000 773.19 1.935 660 770.63 1.929 353
Neat
in CDCl3
