1009-14-9

Valerophenone(1009-14-9) Raman

Product NameValerophenone

CAS 1009-14-9

Molecular FormulaC11H14O

Molecular Weight162.23

InChIInChI=1S/C11H14O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3

InChIKey XKGLSKVNOSHTAD-UHFFFAOYSA-N

SmilesC(C1=CC=CC=C1)(=O)CCCC

Request For Quotation

Valerophenone(1009-14-9) Raman
Mass

MS-NW-5218          
valerophenone
C11H14O             (Mass of molecular ion:    162)

   Source Temperature: 260 °C
   Sample Temperature: 190 °C
   Reservoir, 75 eV

      27.0       5.0
      28.0       3.3
      29.0       4.1
      39.0       3.0
      41.0       3.1
      50.0       3.4
      51.0      12.6
      52.0       1.1
      55.0       2.4
      57.0       1.3
      76.0       1.7
      77.0      44.8
      78.0       6.9
      91.0       1.5
     105.0     100.0
     106.0       8.0
     120.0      47.2
     121.0       4.2
     133.0       2.8
     162.0       4.7

90 MHz in CDCl3

Valerophenone(1009-14-9) Raman

¹H NMR	89.56 MHz
C₁₁ H₁₄ O	0.04 ml : 0.5 ml CDCl₃
valerophenone

    Assign.     Shift(ppm)

      A             7.95
      B             7.51
      C             7.47
      D             2.95
      E             1.72
      F             1.41
      G             0.96

     Hz     ppm     Int.

    717.38   8.011    490
    715.69   7.992    464
    713.88   7.971    229
    712.88   7.960    194
    712.06   7.951    192
    710.13   7.930    356
    709.00   7.917    186
    707.63   7.902    669
    706.13   7.885    120
    677.69   7.567    165
    676.44   7.553    181
    676.06   7.549    183
    674.69   7.534    146
    673.19   7.517    488
    672.19   7.506    849
    671.00   7.493    772
    669.88   7.480    412
    668.94   7.470    343
    668.63   7.466    347
    666.38   7.441    276
    665.38   7.430    288
    664.75   7.423    442
    664.25   7.417    433
    662.38   7.396     76
    661.50   7.387     81
    661.00   7.381    106
    659.44   7.364    175
    658.88   7.357     63
    657.63   7.343     67
    655.75   7.322     94
    272.19   3.040    297
    265.31   2.963    634
    264.63   2.955    417
    257.69   2.878    519
    162.38   1.814    188
    159.88   1.786    102
    159.44   1.781     89
    157.44   1.758     84
    155.69   1.739    235
    154.38   1.724    218
    152.56   1.704    154
    150.69   1.683     71
    148.63   1.660    173
    148.00   1.653    212
    147.06   1.643    233
    146.13   1.632    124
    145.38   1.624     98
    143.31   1.601    117
    141.75   1.583    120
    141.00   1.575    148
    140.13   1.565     96
    139.56   1.559     80
    137.75   1.539    114
    137.38   1.534    115
    136.75   1.527    142
    136.13   1.520    182
    131.63   1.470    159
    130.94   1.463    166
    130.06   1.453    166
    128.56   1.436    241
    127.00   1.419     82
    126.38   1.412     82
    124.25   1.388    179
    121.88   1.361    233
    121.13   1.353    170
    120.13   1.342     90
    119.69   1.337     80
    118.13   1.320     75
    115.38   1.289    197
    114.13   1.275    111
    108.75   1.215     95
     92.56   1.034    311
     91.50   1.022    550
     90.94   1.016    484
     87.88   0.982     62
     87.25   0.975     62
     85.06   0.950   1000
     80.50   0.899     68
     78.88   0.881    176
     77.63   0.867    234
     75.81   0.847    139

in CDCl3