543-59-9

1-氯戊烷(543-59-9)核磁圖(¹HNMR)

產(chǎn)品名稱:1-氯戊烷

CAS:543-59-9

分子式:C5H11Cl

分子量: 106.59

InChI:InChI=1S/C5H11Cl/c1-2-3-4-5-6/h2-5H2,1H3

InChIKey: SQCZQTSHSZLZIQ-UHFFFAOYSA-N

Smiles:C(Cl)CCCC

Mass

MS-NW-9194          
1-chloropentane
C5H11Cl             (Mass of molecular ion:    106)

   Source Temperature: 240 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      15.0       1.0
      26.0       2.5
      27.0      26.8
      28.0       6.1
      29.0      37.7
      36.0       1.3
      38.0       2.1
      39.0      18.7
      40.0       3.7
      41.0      69.7
      42.0     100.0
      43.0      38.9
      44.0       1.3
      49.0       4.1
      50.0       1.0
      51.0       2.2
      53.0       2.7
      54.0       1.5
      55.0      92.9
      56.0       6.3
      57.0      21.9
      58.0       1.0
      62.0       1.3
      63.0       4.8
      65.0       1.6
      69.0       3.0
      70.0      95.1
      71.0       5.9
      77.0       1.1
      91.0       2.7
     106.0       1.0

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₅ H₁₁ Cl	0.04 ml : 0.5 ml CDCl₃
1-chloropentane

    Assign.     Shift(ppm)

      A             3.522
      B             1.78
      C          1.60 to 1.10
      D             0.93

     Hz     ppm     Int.

    322.63   3.603    385
    316.00   3.529   1000
    309.38   3.455    591
    172.88   1.931     31
    168.44   1.881     58
    167.56   1.871     53
    166.13   1.855    115
    164.94   1.842     93
    163.19   1.823     87
    162.81   1.818     85
    162.50   1.815     85
    162.06   1.810     82
    159.63   1.783    176
    158.75   1.773    170
    157.25   1.756    108
    155.00   1.731     84
    153.13   1.710    162
    152.44   1.703    141
    151.25   1.689     97
    149.38   1.668     63
    146.50   1.636     73
    145.50   1.625     50
    144.25   1.611     50
    142.44   1.591     40
    140.13   1.565     58
    138.31   1.545     49
    137.94   1.541     49
    136.56   1.525     98
    135.69   1.516     72
    134.69   1.504     89
    134.31   1.500     87
    132.50   1.480    192
    129.06   1.442    234
    127.75   1.427    236
    126.44   1.412    254
    125.44   1.401    403
    124.38   1.389    324
    122.69   1.370    252
    122.25   1.366    256
    121.50   1.357    331
    120.31   1.344    252
    119.38   1.333    163
    117.75   1.315    363
    115.31   1.288    122
    114.88   1.283    117
    114.56   1.280    116
    113.25   1.265     75
    112.25   1.254     72
    110.44   1.234     66
    109.63   1.225     72
    105.69   1.181     35
    105.00   1.173     31
    104.44   1.167     39
    104.13   1.163     38
    103.81   1.160     40
    101.75   1.137     37
    101.63   1.135     37
     92.06   1.028     51
     91.56   1.023     52
     90.50   1.011     61
     89.38   0.998    179
     88.38   0.987    271
     87.63   0.979    258
     86.44   0.966    163
     85.63   0.957    150
     82.00   0.916    735
     80.00   0.894    172
     79.13   0.884    148
     76.56   0.855    128
     76.06   0.850    131
     74.69   0.834    104
     72.75   0.813     59
     72.13   0.806     54

in CDCl3