4-Amino-2,6-dimethylpyrimidine(461-98-3) MS
Product Name4-Amino-2,6-dimethylpyrimidine
CAS461-98-3
Molecular FormulaC6H9N3
Molecular Weight123.16
InChIInChI=1S/C6H9N3/c1-4-3-6(7)9-5(2)8-4/h3H,1-2H3,(H2,7,8,9)
InChIKey BJJDXAFKCKSLTE-UHFFFAOYSA-N
SmilesC1(C)=NC(C)=CC(N)=N1
-
MassMS-NW-7012 4-amino-2,6-dimethylpyrimidine C6H9N3 (Mass of molecular ion: 123)
Source Temperature: 180 °C Sample Temperature: 110 °C Direct, 75 eV
15.0 6.1 26.0 1.7 27.0 3.6 28.0 7.6 37.0 1.2 38.0 3.1 39.0 11.4 40.0 9.2 41.0 45.0 42.0 45.0 43.0 9.6 51.0 1.0 52.0 3.1 53.0 2.3 54.0 7.6 55.0 5.6 65.0 2.2 66.0 7.3 67.0 9.5 68.0 1.2 81.0 4.1 82.0 7.4 83.0 16.2 84.0 1.0 95.0 8.7 96.0 19.7 97.0 1.9 106.0 1.3 107.0 1.3 108.0 1.3 122.0 4.0 123.0 100.0 124.0 9.1
400 MHz in DMSO-d6
-
1H NMR 399.65 MHz C6 H9 N3 0.039 g : 0.5 ml DMSO-d6 4-amino-2,6-dimethylpyrimidine 
Assign. Shift(ppm)
A 6.63 B 6.086 C *1 2.272 D *1 2.152
Hz ppm Int.2648.56 6.628 177 2432.25 6.086 294 908.33 2.273 1000 860.23 2.153 889
in DMSO-d6
KBr disc
nujol mull
