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6966-10-5

3,4-二甲基苯甲醇(6966-10-5)核磁图(13CNMR)

分子式:C9H12O

分子量: 136.19

InChI:InChI=1S/C9H12O/c1-7-3-4-9(6-10)5-8(7)2/h3-5,10H,6H2,1-2H3

InChIKey: OKGZCXPDJKKZAP-UHFFFAOYSA-N

Smiles:C1(CO)=CC=C(C)C(C)=C1

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    Mass

    MS-NW-9536          
    3,4-dimethylbenzyl alcohol
    C9H12O              (Mass of molecular ion:    136)
    

       Source Temperature: 240 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          18.0       1.9
          27.0       4.3
          29.0       1.7
          39.0       8.5
          40.0       1.0
          41.0       5.2
          43.0       1.5
          50.0       2.5
          51.0       8.1
          52.0       2.3
          53.0       3.9
          55.0       1.2
          60.0       2.9
          62.0       1.3
          63.0       4.3
          65.0      10.1
          66.0       2.2
          67.0       5.8
          74.0       1.0
          75.0       1.0
          77.0      28.2
          78.0       5.5
          79.0      14.0
          80.0       1.0
          89.0       1.8
          91.0      55.7
          92.0       6.6
          93.0      62.2
          94.0       5.0
         102.0       1.4
         103.0       8.0
         104.0       3.0
         105.0      24.5
         106.0       3.0
         107.0      40.9
         108.0       3.7
         115.0       3.4
         117.0       5.4
         118.0       6.6
         119.0      14.0
         120.0       2.7
         121.0      94.6
         122.0       8.4
         133.0       5.0
         134.0       2.7
         135.0       9.4
         136.0     100.0
         137.0      10.0
    

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in CDCl3

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KBr disc

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nujol mull

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4880 A,200 M,powder

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