Chloroacetonitrile(107-14-2) 13C NMR
Product NameChloroacetonitrile
CAS107-14-2
Molecular FormulaC2H2ClN
Molecular Weight75.5
InChIInChI=1S/C2H2ClN/c3-1-2-4/h1H2
InChIKey RENMDAKOXSCIGH-UHFFFAOYSA-N
SmilesC(#N)CCl
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MassMS-NW-1496 chloroacetonitrile C2H2ClN (Mass of molecular ion: 75)
Source Temperature: 250 °C Sample Temperature: 180 °C Reservoir, 75 eV
12.0 3.1 13.0 2.3 14.0 1.8 24.0 1.0 25.0 1.9 26.0 2.8 27.0 1.8 28.0 5.8 35.0 5.7 36.0 1.2 36.5 2.4 37.0 2.2 38.0 11.8 39.0 13.2 40.0 43.4 41.0 1.3 44.0 2.3 47.0 11.1 48.0 84.7 49.0 6.8 50.0 26.5 51.0 1.4 73.0 2.3 74.0 4.5 75.0 100.0 76.0 3.9 77.0 32.1
parameter in CDCl3
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1H NMR 300 MHz C2 H2 Cl N 0.02 ml : 0.5 ml CDCl3 chloroacetonitrile 
Parameter ppm Hz
D(A) 4.113
Hz ppm Int.1233.90 4.113 1000
in CDCl3
liquid film
PHOTOLYSIS OF (C2H5)3SIH/DTBPO/CLCH2CN
