2-Methylimidazole(693-98-1) MS
Product Name2-Methylimidazole
CAS693-98-1
Molecular FormulaC4H6N2
Molecular Weight82.1
InChIInChI=1S/C4H6N2/c1-4-5-2-3-6-4/h2-3H,1H3,(H,5,6)
InChIKey LXBGSDVWAMZHDD-UHFFFAOYSA-N
SmilesC1(C)NC=CN=1
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MassMS-NW-4953 2-methylimidazole C4H6N2 (Mass of molecular ion: 82)
Source Temperature: 260 °C Sample Temperature: 190 °C Reservoir, 75 eV
14.0 1.4 15.0 4.2 25.0 1.0 26.0 7.5 27.0 10.0 28.0 23.0 29.0 1.7 38.0 1.3 39.0 2.1 40.0 8.9 41.0 19.2 42.0 20.5 51.0 2.0 52.0 4.1 53.0 2.9 54.0 38.6 55.0 10.8 80.0 1.3 81.0 37.3 82.0 100.0 83.0 5.5 95.0 2.6 110.0 1.4
90 MHz in CDCl3
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1H NMR 89.56 MHz C4 H6 N2 0.024 g : 0.5 ml CDCl3 2-methylimidazole 
Assign. Shift(ppm)
A 11.95 B 6.961 C 2.426
Hz ppm Int.1070.00 11.948 166 623.52 6.963 645 217.38 2.428 1000
in CDCl3
KBr disc
nujol mull
