874-43-1

4-氨基-2-甲基-5-(氨甲基)嘧啶鹽酸鹽(874-43-1)質(zhì)譜(MS)

產(chǎn)品名稱:4-氨基-2-甲基-5-(氨甲基)嘧啶鹽酸鹽

CAS:874-43-1

分子式:C6H12Cl2N4

分子量: 211.09228

InChI:InChI=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

Smiles:NC1C(CN)=CN=C(C)N=1.[H]Cl.[H]Cl

Mass

MS-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

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