Isopropyl 2-cyanoacetate(13361-30-3) 13C NMR
Molecular FormulaC6H9NO2
Molecular Weight127.14
InChIInChI=1S/C6H9NO2/c1-5(2)9-6(8)3-4-7/h5H,3H2,1-2H3
InChIKey BESQLCCRQYTQQI-UHFFFAOYSA-N
SmilesC(OC(C)C)(=O)CC#N
-
![](https://www.chemicalbook.com/Spectrum/13361-30-3_MS.gif)
Mass
MS-IW-9148
isopropyl cyanoacetate
C6H9NO2 (Mass of molecular ion: 127)
Source Temperature: 220 °C
Sample Temperature: 150 °C
Reservoir, 75 eV
15.0 2.9
18.0 1.1
26.0 1.6
27.0 13.0
28.0 3.6
29.0 2.2
31.0 1.9
37.0 1.1
38.0 3.9
39.0 15.6
40.0 15.3
41.0 33.6
42.0 18.6
43.0 46.6
44.0 9.4
45.0 28.8
59.0 7.3
67.0 3.6
68.0 100.0
69.0 3.7
82.0 2.3
86.0 11.0
87.0 1.5
112.0 6.5