26392-49-4

2-乙基己胺鹽酸鹽(26392-49-4)質(zhì)譜(MS)

產(chǎn)品名稱:2-乙基己胺鹽酸鹽

CAS:26392-49-4

分子式:C8H20ClN

分子量: 165.7

InChI:InChI=1S/C8H19N.ClH/c1-3-5-6-8(4-2)7-9;/h8H,3-7,9H2,1-2H3;1H

InChIKey: JNWRGTDFPPYRAD-UHFFFAOYSA-N

Smiles:C(CN)(CC)CCCC.Cl

Mass

MS-NW-8250          
2-ethylhexylamine hydrochloride
C8H19N HCl          (Mass of molecular ion:    129)

   Source Temperature: 170 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      18.0       4.2
      27.0       3.4
      28.0       2.8
      29.0       4.6
      30.0     100.0
      31.0       2.9
      32.0       5.7
      35.0       1.6
      36.0      12.8
      38.0       4.3
      39.0       2.5
      41.0       8.5
      42.0       2.1
      43.0       3.5
      44.0       1.3
      55.0       4.9
      56.0       6.2
      57.0       3.0
      69.0       2.5
      70.0       2.9
      72.0       1.4
      73.0       2.2
      83.0       1.3
     100.0       1.3
     112.0       4.3
     129.0       5.2

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₈ H₁₉ N	0.061 g : 0.5 ml CDCl₃
2-ethylhexylamine hydrochloride

    Assign.     Shift(ppm)

      A             8.3
      B             2.9
      C             1.78
      D          1.68 to 1.09
      E             0.92
      F             0.90

     Hz     ppm     Int.

    739.31   8.255    131
    302.31   3.376     37
    301.56   3.368     41
    301.06   3.362     42
    300.13   3.352     41
    260.25   2.906    162
    166.44   1.859     30
    164.44   1.837     43
    163.56   1.827     38
    163.13   1.822     38
    161.94   1.809     41
    159.56   1.782     62
    159.06   1.777     63
    158.75   1.773     64
    156.25   1.745     48
    155.25   1.734     51
    154.88   1.730     54
    153.44   1.714     65
    152.94   1.708     65
    150.81   1.684     44
    150.13   1.677     41
    147.13   1.643     77
    146.63   1.638     76
    143.06   1.598     56
    139.44   1.557    192
    137.25   1.533     83
    132.00   1.474    310
    125.56   1.402    366
    119.50   1.335    723
    112.63   1.258    165
    103.56   1.157     41
    103.00   1.151     40
    102.06   1.140     38
    101.31   1.132     34
    100.94   1.128     34
    100.13   1.119     31
     96.19   1.075     31
     95.81   1.070     34
     94.19   1.052     42
     93.88   1.049     43
     89.13   0.996    489
     85.25   0.952    252
     82.44   0.921   1000
     81.00   0.905    954
     74.88   0.837    332

in CDCl3