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80-18-2

苯磺酸甲酯(80-18-2)红外图谱(IR1)

产品名称:苯磺酸甲酯

CAS:80-18-2

分子式:C7H8O3S

分子量: 172.2

InChI:InChI=1S/C7H8O3S/c1-10-11(8,9)7-5-3-2-4-6-7/h2-6H,1H3

InChIKey: CZXGXYBOQYQXQD-UHFFFAOYSA-N

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

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    Mass

    MS-NW-4185          
    methyl benzenesulfonate
    C7H8O3S             (Mass of molecular ion:    172)
    

       Source Temperature: 230 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          15.0       4.1
          27.0       2.1
          28.0       2.5
          29.0       1.5
          38.0       1.1
          39.0       3.6
          50.0       8.8
          51.0      27.5
          52.0       1.7
          65.0       5.2
          74.0       2.4
          75.0       2.0
          76.0       2.5
          77.0     100.0
          78.0      22.5
          79.0      10.5
          93.0       1.3
         108.0       9.3
         125.0       1.8
         141.0      29.9
         142.0       4.4
         143.0       1.6
         172.0      27.5
         173.0       2.5
         174.0       1.3
    

in CDCl3

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liquid film

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