3481-02-5

苯基環(huán)丙基甲酮(3481-02-5)核磁圖(¹³CNMR)

產(chǎn)品名稱:苯基環(huán)丙基甲酮

CAS:3481-02-5

分子式:C10H10O

分子量: 146.19

InChI:InChI=1S/C10H10O/c11-10(9-6-7-9)8-4-2-1-3-5-8/h1-5,9H,6-7H2

InChIKey: PJRHFTYXYCVOSJ-UHFFFAOYSA-N

Smiles:C(C1CC1)(C1=CC=CC=C1)=O

Mass

MS-NW-7072          
cyclopropyl phenyl ketone
C10H10O             (Mass of molecular ion:    146)

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

      27.0       2.2
      28.0       1.1
      38.0       1.2
      39.0       7.7
      40.0       1.4
      41.0       8.5
      50.0       5.3
      51.0      17.1
      52.0       1.5
      63.0       1.8
      69.0       9.4
      74.0       1.8
      75.0       1.4
      76.0       2.0
      77.0      48.5
      78.0       4.2
      89.0       1.1
      91.0       1.9
     105.0     100.0
     106.0       7.8
     115.0       3.3
     116.0       1.3
     117.0       2.9
     127.0       1.9
     131.0       1.2
     145.0       7.8
     146.0      24.3
     147.0       2.9

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₀ H₁₀ O	0.05 ml : 0.5 ml CDCl₃
cyclopropyl phenyl ketone

    Assign.     Shift(ppm)

      A             8.005
      B             7.528
      C             7.447
      D             2.653
      E             1.226
      F             1.013

     Hz     ppm     Int.

   3205.20   8.021    188
   3203.25   8.016    785
   3202.03   8.013    826
   3197.02   8.000    314
   3194.95   7.995    980
   3193.48   7.991    783
   3017.46   7.551    231
   3016.11   7.547    138
   3012.33   7.538    182
   3010.25   7.533    519
   3008.06   7.527    198
   3004.15   7.517    289
   3002.81   7.514    472
   3001.46   7.511    253
   2984.13   7.467    213
   2982.79   7.464    644
   2982.18   7.462    717
   2980.83   7.459    350
   2975.83   7.447    629
   2974.61   7.444   1000
   2968.87   7.429    216
   2967.29   7.425    457
   2966.31   7.423    316
   1072.63   2.684    131
   1068.12   2.673    266
   1064.82   2.665    281
   1063.60   2.662    180
   1060.30   2.654    503
   1056.88   2.645    180
   1055.66   2.642    283
   1052.37   2.634    268
   1047.85   2.622    137
    497.80   1.246    258
    494.14   1.237    628
    490.48   1.228    861
    489.62   1.226    689
    485.96   1.216    744
    482.79   1.209    269
    472.17   1.182     39
    467.65   1.171     34
    428.59   1.073     34
    420.65   1.053     40
    413.82   1.036    294
    410.28   1.027    781
    406.74   1.018    609
    402.47   1.008    754
    398.80   0.998    569
    395.39   0.990    225

in CDCl3