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80-48-8

对甲苯磺酸甲酯(80-48-8)核磁图(13CNMR)

产品名称:对甲苯磺酸甲酯

CAS:80-48-8

分子式:C8H10O3S

分子量: 186.23

InChI:InChI=1S/C8H10O3S/c1-7-3-5-8(6-4-7)12(9,10)11-2/h3-6H,1-2H3

InChIKey: VUQUOGPMUUJORT-UHFFFAOYSA-N

Smiles:C1(S(OC)(=O)=O)=CC=C(C)C=C1

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    Mass

    MS-NW-0746          
    methyl p-toluenesulfonate
    C8H10O3S            (Mass of molecular ion:    186)
    

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

          15.0       3.4
          18.0       3.5
          27.0       1.5
          28.0       5.4
          32.0       1.6
          38.0       1.3
          39.0      11.6
          41.0       3.5
          43.0       1.8
          50.0       3.4
          51.0       5.0
          52.0       1.4
          53.0       1.3
          62.0       2.4
          63.0       8.4
          64.0       2.3
          65.0      20.9
          66.0       1.2
          77.0       4.7
          78.0       1.1
          79.0       3.7
          89.0       7.4
          90.0       6.1
          91.0     100.0
          92.0      15.0
          93.0       1.0
         107.0      11.3
         108.0       1.3
         121.0       1.8
         122.0       4.9
         139.0       1.4
         155.0      40.7
         156.0       3.6
         157.0       2.0
         186.0      42.6
         187.0       4.2
         188.0       2.5
    

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in CDCl3

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liquid film

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