3003-84-7

2-氯甲基四氢呋喃(3003-84-7)核磁图(¹³CNMR)

产品名称:2-氯甲基四氢呋喃

CAS:3003-84-7

分子式:C5H9ClO

分子量: 120.58

InChI:InChI=1S/C5H9ClO/c6-4-5-2-1-3-7-5/h5H,1-4H2

InChIKey: IVJLGIMHHWKRAN-UHFFFAOYSA-N

Smiles:O1CCCC1CCl

Mass

MS-NW-1058          
tetrahydrofurfuryl chloride
C5H9ClO             (Mass of molecular ion:    120)

   Source Temperature: 240 °C
   Sample Temperature: 170 °C
   Reservoir, 75 eV

      15.0       1.4
      26.0       1.7
      27.0      14.9
      28.0       1.0
      29.0       5.1
      31.0       1.1
      39.0       8.2
      40.0       2.5
      41.0      26.6
      42.0      17.5
      43.0      42.1
      44.0       1.4
      49.0       3.2
      51.0       1.0
      53.0       2.3
      54.0       1.6
      55.0       7.7
      62.0       1.7
      71.0     100.0
      72.0       4.6
      75.0       1.3
      77.0       2.5
      79.0       1.2

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₅ H₉ Cl O	0.02 ml : 0.5 ml CDCl₃
tetrahydrofurfuryl chloride

    Assign.     Shift(ppm)

      A             4.15
      B             3.87
      C     *1      3.56
      D     *1      3.50
      E          2.24 to 1.61

     Hz     ppm     Int.

    371.56   4.149    146
    371.25   4.146    147
    350.50   3.914    171
    348.50   3.892    269
    347.69   3.883    141
    343.88   3.840    278
    342.81   3.828    170
    342.00   3.819    160
    318.81   3.560   1000
    313.69   3.503    600
    312.56   3.490    548
    183.19   2.046    207
    182.81   2.042    213
    179.75   2.008    235
    179.25   2.002    240
    176.75   1.974    339
    174.56   1.950    197
    173.31   1.936    347
    172.81   1.930    343
    172.19   1.923    270
    171.44   1.915    214
    170.00   1.899    195
    169.19   1.890    185
    168.44   1.881    253
    167.56   1.871    194
    166.63   1.861    261
    164.88   1.842    149
    164.31   1.835    149
    159.94   1.786    155

in CDCl3