2-Cyanoethyl ether (1656-48-0) MS
Product Name2-Cyanoethyl ether
CAS1656-48-0
Molecular FormulaC6H8N2O
Molecular Weight124.14
InChIInChI=1S/C6H8N2O/c7-3-1-5-9-6-2-4-8/h1-2,5-6H2
InChIKey BCGCCTGNWPKXJL-UHFFFAOYSA-N
SmilesO(CCC#N)CCC#N
-
MassMS-NW-1339 3,3'-oxydipropionitrile C6H8N2O (Mass of molecular ion: 124)
Source Temperature: 260 °C Sample Temperature: 180 °C Reservoir, 75 eV
15.0 1.9 26.0 3.7 27.0 9.3 28.0 16.3 29.0 4.1 31.0 19.3 39.0 1.1 40.0 3.2 41.0 4.7 42.0 3.9 51.0 1.5 52.0 4.3 53.0 1.5 54.0 100.0 55.0 5.4 84.0 28.0 85.0 1.2 97.0 3.7
90 MHz in CDCl3
-
1H NMR 89.56 MHz C6 H8 N2 O 0.04 ml : 0.5 ml CDCl3 3,3'-oxydipropionitrile 
Assign. Shift(ppm)
A 3.74 B 2.65
Hz ppm Int.341.50 3.814 396 338.44 3.779 21 335.00 3.741 908 332.25 3.710 30 329.06 3.675 542 243.69 2.721 524 237.50 2.652 1000 231.25 2.583 401
in CDCl3
CCl4 solution
liquid film
4880 A,200 M,liquid
