5-aminomethyl-2-methylpyrimidin-4-ylamine dihydrochloride (874-43-1) MS
Molecular FormulaC6H12Cl2N4
Molecular Weight211.09228
InChIInChI=1S/C6H10N4.2ClH/c1-4-9-3-5(2-7)6(8)10-4;;/h3H,2,7H2,1H3,(H2,8,9,10);2*1H
InChIKey FRWHCPFBMJIPLY-UHFFFAOYSA-N
SmilesNC1C(CN)=CN=C(C)N=1.[H]Cl.[H]Cl
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MassMS-NW-6202 4-amino-5-aminomethyl-2-methylpyrimidine dihydrochloride C6H10N4 2HCl (Mass of molecular ion: 138)
Source Temperature: 220 °C Sample Temperature: 200 °C Direct, 75 eV
15.0 3.5 17.0 2.1 18.0 7.8 26.0 1.5 27.0 2.7 28.0 12.7 29.0 2.5 30.0 14.5 35.0 5.9 36.0 42.8 37.0 1.9 38.0 13.2 39.0 5.6 40.0 6.2 41.0 7.1 42.0 27.3 43.0 3.6 45.0 1.2 51.0 1.4 52.0 8.4 53.0 17.6 54.0 9.7 55.0 7.2 66.0 2.3 67.0 3.6 68.0 4.9 69.0 13.3 70.0 10.4 79.0 2.9 80.0 25.5 81.0 10.5 82.0 2.5 93.0 2.1 94.0 3.2 95.0 1.9 96.0 14.5 97.0 3.4 108.0 1.7 109.0 3.5 110.0 12.2 111.0 1.3 120.0 3.2 121.0 18.4 122.0 11.9 123.0 1.4 137.0 15.2 138.0 100.0 139.0 9.2
400 MHz in DMSO-d6
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1H NMR 399.65 MHz C6 H10 N4 0.039 g : 0.5 ml DMSO-d6 4-amino-5-aminomethyl-2-methylpyrimidine dihydrochloride 
Assign. Shift(ppm)
A 8.428 B 4.07 C 2.544
Hz ppm Int.3687.29 9.227 30 3629.91 9.083 29 3515.63 8.797 93 3368.23 8.428 273 1627.20 4.072 191 1016.85 2.545 1000
in DMSO-d6
KBr disc
nujol mull
