2043-47-2

1H,1H,2H,2H-全氟己-1-醇(2043-47-2)質(zhì)譜(MS)

產(chǎn)品名稱:1H,1H,2H,2H-全氟己-1-醇

CAS:2043-47-2

分子式:C6H5F9O

分子量: 264.09

InChI:InChI=1S/C6H5F9O/c7-3(8,1-2-16)4(9,10)5(11,12)6(13,14)15/h16H,1-2H2

InChIKey: JCMNMOBHVPONLD-UHFFFAOYSA-N

Smiles:C(O)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)F

¹HNMR

IR1

Mass

MS-IW-7443          
3,3,4,4,5,5,6,6,6-nonafluoro-1-hexanol
C6H5F9O             (Mass of molecular ion:    264)

   Source Temperature: 220 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      27.0       2.9
      28.0       3.4
      29.0      16.4
      30.0       2.9
      31.0     100.0
      32.0       2.7
      33.0       1.1
      43.0       2.4
      44.0       1.8
      45.0       3.1
      47.0       1.5
      49.0       9.2
      51.0       5.5
      57.0       1.6
      64.0       2.7
      65.0      14.8
      67.0       1.7
      69.0      22.8
      75.0       4.9
      77.0       8.0
      93.0       1.6
      95.0      38.4
      96.0       1.4
     100.0       3.9
     113.0       2.3
     119.0       5.3
     127.0       4.7
     131.0       4.8
     145.0       3.7
     157.0       1.3
     169.0       1.0
     175.0       2.2
     195.0       6.8
     196.0       9.8
     214.0       2.7
     215.0       1.3
     227.0       1.3
     244.0       9.4
     263.0       3.7
     265.0       1.3

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₆ H₅ F₉ O	0.05 ml : 0.5 ml CDCl₃
3,3,4,4,5,5,6,6,6-nonafluoro-1-hexanol

    Assign.     Shift(ppm)

      A             3.960
      B             2.97
      C             2.364

     Hz     ppm     Int.

   1591.92   3.984    397
   1585.69   3.968    964
   1580.08   3.954   1000
   1573.85   3.939    432
   1191.65   2.982    324
   1186.16   2.968    772
   1180.79   2.955    314
    973.14   2.435    113
    971.68   2.432    197
    970.09   2.428    125
    966.80   2.420    224
    965.33   2.416    378
    963.75   2.412    229
    960.33   2.403    125
    958.86   2.400    196
    957.28   2.396    130
    952.76   2.384    353
    946.29   2.368    665
    939.94   2.352    342
    935.42   2.341    143
    933.84   2.337    222
    932.25   2.333    141
    928.96   2.325    242
    927.37   2.321    407
    925.90   2.317    244
    922.49   2.309    135
    920.90   2.305    222
    919.56   2.301    130

liquid film