ETHYL METHYL SULFONE(594-43-4) MS
Product NameETHYL METHYL SULFONE
CAS594-43-4
Molecular FormulaC3H8O2S
Molecular Weight108.16
InChIInChI=1S/C3H8O2S/c1-3-6(2,4)5/h3H2,1-2H3
InChIKey YBJCDTIWNDBNTM-UHFFFAOYSA-N
SmilesCCS(C)(=O)=O
-
MassMS-IW-8102 ethyl methyl sulfone C3H8O2S (Mass of molecular ion: 108)
Source Temperature: 210 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 7.0 17.0 1.3 18.0 5.9 26.0 2.9 27.0 29.9 28.0 6.4 29.0 77.6 30.0 2.0 31.0 3.8 45.0 1.7 47.0 1.1 48.0 2.1 50.0 1.9 63.0 4.4 64.0 1.8 65.0 35.8 67.0 1.7 79.0 4.5 80.0 100.0 81.0 3.8 82.0 5.2 93.0 11.0 108.0 9.2 109.0 6.7
400 MHz in CDCl3
-
1H NMR 399.65 MHz C3 H8 O2 S 0.040 g : 0.05 ml CDCl3 ethyl methyl sulfone 
Assign. Shift(ppm)
A 3.056 B 2.906 C 1.424
Hz ppm Int.1233.28 3.086 71 1232.67 3.085 73 1225.71 3.067 215 1225.22 3.066 222 1218.26 3.049 223 1217.65 3.047 231 1210.82 3.030 80 1210.21 3.029 82 1161.38 2.906 1000 1160.89 2.905 764 576.90 1.444 462 569.34 1.425 893 561.89 1.406 468
in CDCl3
