583-03-9

Fenipentol(583-03-9) MS

Product NameFenipentol

CAS 583-03-9

Molecular FormulaC11H16O

Molecular Weight164.25

InChIInChI=1S/C11H16O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h4-8,11-12H,2-3,9H2,1H3

InChIKey OVGORFFCBUIFIA-UHFFFAOYSA-N

SmilesC(C1C=CC=CC=1)(O)CCCC

Request For Quotation

¹HNMR

¹³CNMR

IR1

Fenipentol(583-03-9) MS
Mass

MS-IW-1793          
1-phenyl-1-pentanol
C11H16O             (Mass of molecular ion:    164)

   Source Temperature: 230 °C
   Sample Temperature: 160 °C
   Reservoir, 75 eV

      27.0       1.5
      29.0       1.5
      39.0       1.7
      41.0       1.8
      51.0       3.4
      57.0       1.1
      77.0      14.8
      78.0       3.5
      79.0      34.3
      80.0       2.3
      91.0       2.8
     103.0       1.1
     104.0       1.5
     105.0       6.9
     106.0       1.1
     107.0     100.0
     108.0       8.2
     115.0       1.2
     117.0       2.6
     120.0       1.6
     163.0       2.0
     164.0       6.5

400 MHz in CDCl3

Fenipentol(583-03-9) MS

¹H NMR	399.65 MHz
C₁₁ H₁₆ O	0.05 ml : 0.5 ml CDCl₃
1-phenyl-1-pentanol

    Assign.     Shift(ppm)

      A             7.30
      B             7.28
      C             7.22
      D             4.550
      E             2.6
      F     *1      1.73
      G     *1      1.64
      J     *2      1.33
      K             1.29
      L     *2      1.19
      M             0.861

     Hz     ppm     Int.

   2924.80   7.319     89
   2923.58   7.316    124
   2922.00   7.312     67
   2921.02   7.309     43
   2918.09   7.302    201
   2916.26   7.298    435
   2915.16   7.295    391
   2912.96   7.289    149
   2911.13   7.285    600
   2910.64   7.283    624
   2909.42   7.280    959
   2908.33   7.278    843
   2903.93   7.267    140
   2902.34   7.263    216
   2900.02   7.257     80
   2895.39   7.245    179
   2893.43   7.240    167
   2892.46   7.238    132
   2889.89   7.232    146
   2888.67   7.229    102
   2886.72   7.224    188
   2885.62   7.221    113
   2883.30   7.215    113
   2880.49   7.208     95
   2879.03   7.204    156
   2878.17   7.202     65
   1825.44   4.568    164
   1819.34   4.553    205
   1818.12   4.550    206
   1812.01   4.534    171
   1045.65   2.617     34
   1037.35   2.596     33
    707.03   1.770     31
    701.66   1.756     57
    699.58   1.751     45
    698.61   1.749     61
    696.90   1.744     62
    694.21   1.738     69
    693.60   1.736     76
    691.16   1.730     62
    689.45   1.726     68
    688.35   1.723    116
    686.16   1.717     72
    683.35   1.710     82
    680.91   1.704    107
    675.90   1.692     77
    672.12   1.682     44
    666.38   1.668    108
    661.99   1.657     69
    660.40   1.653     91
    658.69   1.649     49
    656.49   1.643    100
    652.95   1.634     65
    650.51   1.628     90
    648.32   1.623     47
    646.97   1.619     50
    643.07   1.610     56
    637.08   1.595     41
    548.95   1.374     46
    543.95   1.362     53
    541.75   1.356     53
    540.16   1.352     37
    538.94   1.349     45
    536.62   1.343     53
    535.28   1.340     64
    531.37   1.330    109
    530.03   1.327    105
    526.00   1.317    175
    525.02   1.314    188
    521.85   1.306    124
    519.90   1.301    286
    512.82   1.284    347
    505.86   1.266    235
    499.15   1.249     76
    493.77   1.236     42
    493.04   1.234     38
    489.38   1.225     52
    487.79   1.221     41
    486.45   1.218     41
    483.89   1.211     83
    483.15   1.209     82
    480.59   1.203     40
    479.00   1.199     56
    477.54   1.195     70
    475.22   1.190     70
    473.51   1.185     58
    472.78   1.183     61
    470.21   1.177     64
    467.16   1.169     52
    465.09   1.164     61
    459.59   1.150     32
    351.07   0.879    525
    344.12   0.862   1000
    339.97   0.851    111
    338.62   0.848    142
    336.79   0.843    437

in CDCl3