123-84-2

N-(2-羥基丙基)乙二胺(123-84-2)質(zhì)譜(MS)

產(chǎn)品名稱:N-(2-羥基丙基)乙二胺

CAS:123-84-2

分子式:C5H14N2O

分子量: 118.18

InChI:InChI=1S/C5H14N2O/c1-5(8)4-7-3-2-6/h5,7-8H,2-4,6H2,1H3

InChIKey: CWKVFRNCODQPDB-UHFFFAOYSA-N

Smiles:C(NCCN)C(O)C

Mass

MS-NW-1013          
1-(2-aminoethylamino)-2-propanol
C5H14N2O            (Mass of molecular ion:    118)

   Source Temperature: 260 °C
   Sample Temperature: 130 °C
   Reservoir, 75 eV

      15.0       4.9
      17.0       2.8
      18.0      14.0
      26.0       1.1
      27.0       6.2
      28.0      16.9
      29.0       4.0
      30.0      50.0
      31.0       6.9
      32.0       1.4
      39.0       3.3
      40.0       1.4
      41.0      30.4
      42.0      50.1
      43.0      13.9
      44.0     100.0
      45.0       5.8
      54.0       1.8
      55.0       2.3
      56.0      11.6
      57.0       3.2
      58.0      11.5
      59.0       3.5
      68.0       1.5
      69.0       1.7
      70.0      57.0
      71.0       4.9
      72.0       1.3
      73.0      34.0
      74.0       7.6
      83.0       1.1
      84.0       1.1
      85.0       3.9
      86.0       2.5
      88.0      82.3
      89.0       4.7
      99.0       1.1
     100.0       7.4
     113.0       1.1

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₅ H₁₄ N₂ O	0.04 ml : 0.5 ml CDCl₃
1-(2-aminoethylamino)-2-propanol

    Assign.     Shift(ppm)

      A             3.82
      B          2.93 to 2.52
      C     *1      2.71
      D     *1      2.64
      E             2.16
      F             1.151

     Hz     ppm     Int.

    344.44   3.846     64
    341.88   3.818     68
    341.75   3.816     68
    338.31   3.778     72
    256.94   2.869     95
    252.63   2.821    125
    251.94   2.814    185
    251.38   2.807    182
    250.88   2.802    189
    248.75   2.778    422
    246.81   2.756    280
    245.06   2.737    511
    241.94   2.702    181
    241.56   2.698    180
    240.88   2.690    184
    239.69   2.677    121
    236.50   2.641    318
    233.00   2.602    263
    228.50   2.552    263
    219.69   2.453    212
    216.50   2.418     80
    207.69   2.320     86
    193.56   2.162    839
    106.13   1.186   1000
     99.88   1.116    945

in CDCl3