534-03-2

2-Amino-1,3-propanediol(534-03-2) IR1

Product Name2-Amino-1,3-propanediol

CAS 534-03-2

Molecular FormulaC3H9NO2

Molecular Weight91.11

InChIInChI=1S/C3H9NO2/c4-3(1-5)2-6/h3,5-6H,1-2,4H2

InChIKey KJJPLEZQSCZCKE-UHFFFAOYSA-N

SmilesC(O)C(N)CO

Request For Quotation

2-Amino-1,3-propanediol(534-03-2) IR1
Mass

MS-IW-4865          
2-amino-1,3-propanediol
C3H9NO2             (Mass of molecular ion:     91)

   Source Temperature: 210 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      15.0       8.6
      17.0       4.7
      18.0      22.6
      27.0       2.2
      28.0       8.8
      29.0       4.2
      30.0      12.4
      31.0       6.9
      41.0       3.0
      42.0      53.6
      43.0       9.2
      44.0      11.1
      45.0       5.0
      55.0       1.0
      56.0       1.2
      58.0       1.0
      59.0       2.7
      60.0     100.0
      61.0       4.5
      71.0       1.6
      72.0       1.9
      75.0       2.0
     102.0       1.2
     114.0       3.0
     115.0       2.3
     168.0       1.3
     169.0       1.2

400 MHz in DMSO-d6

2-Amino-1,3-propanediol(534-03-2) IR1

¹H NMR	399.65 MHz
C₃ H₉ N O₂	0.040 g : 0.5 ml DMSO-d₆
2-amino-1,3-propanediol

    Assign.     Shift(ppm)

      A     *1      3.336
      B     *1      3.216
      C             2.656

     Hz     ppm     Int.

   1342.29   3.359    659
   1336.91   3.346    704
   1331.91   3.333    936
   1326.54   3.320    940
   1292.72   3.235    951
   1286.50   3.220   1000
   1282.23   3.209    661
   1276.12   3.194    682
   1072.75   2.685    100
   1067.02   2.670    270
   1061.28   2.656    368
   1055.54   2.642    244
   1049.68   2.627     82

in DMSO-d6