104-78-9

3-二乙胺基丙胺(104-78-9)核磁圖(¹³CNMR)

產(chǎn)品名稱:3-二乙胺基丙胺

CAS:104-78-9

分子式:C7H18N2

分子量: 130.23

InChI:InChI=1S/C7H18N2/c1-3-9(4-2)7-5-6-8/h3-8H2,1-2H3

InChIKey: QOHMWDJIBGVPIF-UHFFFAOYSA-N

Smiles:C(N(CC)CC)CCN

Mass

MS-NW-0854          
N,N-diethyltrimethylenediamine
C7H18N2             (Mass of molecular ion:    130)

   Source Temperature: 280 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      18.0       1.5
      27.0       4.4
      28.0       7.9
      29.0       6.6
      30.0      24.4
      41.0       3.5
      42.0       8.4
      43.0       2.2
      44.0       8.5
      54.0       1.0
      56.0       8.9
      57.0       5.2
      58.0      27.7
      59.0       1.3
      70.0       2.3
      71.0       1.3
      72.0      42.6
      73.0       2.4
      74.0       3.9
      84.0       2.8
      85.0       1.5
      86.0     100.0
      87.0       6.3
      98.0       3.3
     100.0       3.5
     101.0       2.6
     113.0       5.2
     130.0       9.8

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₇ H₁₈ N₂	0.04 ml : 0.5 ml CDCl₃
N,N-diethyltrimethylenediamine

    Assign.     Shift(ppm)

      A             2.723
      B             2.501
      C             2.49
      D             1.59
      E             1.47
      F             1.021

     Hz     ppm     Int.

    251.31   2.807     98
    244.50   2.731    231
    237.69   2.654    140
    236.38   2.640    131
    235.88   2.634    116
    228.88   2.556    516
    221.69   2.476    616
    220.19   2.459     88
    219.31   2.449     91
    214.44   2.395    278
    157.06   1.754     35
    156.06   1.743     35
    150.88   1.685     35
    150.00   1.675     78
    149.06   1.665     80
    144.44   1.613     41
    142.25   1.589    103
    135.75   1.516     64
    134.94   1.507     81
    132.06   1.475    258
    129.00   1.441     39
    128.00   1.430     31
     98.19   1.097    489
     91.19   1.019   1000
     83.94   0.938    380

in CDCl3