4-MORPHOLINECARBONITRILE(1530-89-8) MS
Product Name4-MORPHOLINECARBONITRILE
CAS1530-89-8
Molecular FormulaC5H8N2O
Molecular Weight112.13
InChIInChI=1S/C5H8N2O/c6-5-7-1-3-8-4-2-7/h1-4H2
InChIKey BOQOXLAQTDFJKU-UHFFFAOYSA-N
SmilesN1(C#N)CCOCC1
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MassMS-NW-8330 4-morpholinecarbonitrile C5H8N2O (Mass of molecular ion: 112)
Source Temperature: 250 °C Sample Temperature: 130 °C Reservoir, 75 eV
15.0 5.0 26.0 3.2 27.0 9.1 28.0 42.0 29.0 7.5 30.0 2.8 31.0 2.0 40.0 2.4 41.0 5.2 42.0 100.0 43.0 5.7 44.0 2.9 53.0 7.6 54.0 21.5 55.0 47.6 56.0 4.4 57.0 8.5 58.0 1.2 67.0 4.7 72.0 1.2 81.0 2.1 82.0 3.8 111.0 2.3 112.0 40.7 113.0 2.8
400 MHz in CDCl3
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1H NMR 399.65 MHz C5 H8 N2 O 0.05 ml : 0.5 ml CDCl3 4-morpholinecarbonitrile 
Assign. Shift(ppm)
A 3.733 B 3.247
Hz ppm Int.1510.25 3.779 26 1505.37 3.767 45 1497.19 3.747 942 1492.31 3.735 890 1490.48 3.730 508 1487.43 3.722 933 1315.55 3.292 25 1310.67 3.280 43 1302.49 3.260 1000 1299.07 3.251 540 1297.49 3.247 918 1296.02 3.243 554 1292.60 3.235 882 1284.67 3.215 33
in CDCl3
liquid film
4880 A,200 M,liquid
