Product Name3-Aminopropionitrile
CAS151-18-8
Molecular FormulaC3H6N2
Molecular Weight70.09
InChIInChI=1S/C3H6N2/c4-2-1-3-5/h1-2,4H2
InChIKey AGSPXMVUFBBBMO-UHFFFAOYSA-N
SmilesC(#N)CCN
Mass
MS-IW-3444 3-aminopropionitrile C3H6N2 (Mass of molecular ion: 70)
Source Temperature: 220 °C Sample Temperature: 160 °C Reservoir, 75 eV
14.0 1.9 15.0 6.2 17.0 3.0 18.0 2.0 25.0 1.3 26.0 6.9 27.0 8.6 28.0 71.1 29.0 5.7 30.0 100.0 31.0 5.4 32.0 3.5 33.5 1.3 34.0 1.3 38.0 8.2 39.0 10.4 40.0 20.1 41.0 25.9 42.0 62.8 43.0 4.4 50.0 1.3 51.0 6.9 52.0 9.6 53.0 4.3 54.0 5.0 66.0 3.1 67.0 4.6 68.0 1.3 69.0 7.2 70.0 4.5
90 MHz in CDCl3
1H NMR | 89.56 MHz |
C3 H6 N2 | 0.04 ml : 0.5 ml CDCl3 |
3-aminopropionitrile |
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Assign. Shift(ppm) |
Hz ppm Int.
275.75 3.079 156 274.81 3.069 179 269.13 3.006 278 268.44 2.998 470 262.88 2.936 270 262.25 2.929 312 228.56 2.553 270 227.88 2.545 295 226.25 2.527 29 222.31 2.483 421 221.31 2.472 275 216.00 2.412 157 215.06 2.402 164 124.25 1.388 1000
in CDCl3
KBr disc
liquid film
nujol mull
3-Aminopropionitrile(151-18-8) IR3 Atlas of Related Products
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