2,4,4-TRIMETHYL-2-OXAZOLINE(1772-43-6) MS
Product Name2,4,4-TRIMETHYL-2-OXAZOLINE
CAS1772-43-6
Molecular FormulaC6H11NO
Molecular Weight113.16
InChIInChI=1S/C6H11NO/c1-5-7-6(2,3)4-8-5/h4H2,1-3H3
InChIKey HZRZMHNRCSIQFT-UHFFFAOYSA-N
SmilesO1CC(C)(C)N=C1C
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MassMS-NW-5667 2,4,4-trimethyl-2-oxazoline C6H11NO (Mass of molecular ion: 113)
Source Temperature: 260 °C Sample Temperature: 190 °C Reservoir, 75 eV
15.0 7.1 26.0 1.6 27.0 7.0 28.0 2.1 29.0 6.2 38.0 1.3 39.0 8.3 40.0 3.5 41.0 12.6 42.0 100.0 43.0 9.9 55.0 1.4 56.0 2.4 57.0 13.9 58.0 1.0 68.0 1.2 70.0 9.6 71.0 1.1 82.0 1.5 83.0 32.2 84.0 2.2 98.0 67.0 99.0 4.3 113.0 7.3
parameter in CDCl3
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1H NMR 300 MHz C6 H11 N O 0.04 ml : 0.5 ml CDCl3 2,4,4-trimethyl-2-oxazoline 
Parameter ppm Hz
D(A) 3.906 D(B) 1.944 D(C) 1.260
Hz ppm Int.1171.79 3.906 333 583.19 1.944 500 377.99 1.260 1000
in CDCl3
liquid film
4880 A,200 M,liquid
