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1878-91-7

对溴苯氧乙酸(1878-91-7)核磁图(13CNMR)

产品名称:对溴苯氧乙酸

CAS:1878-91-7

分子式:C8H7BrO3

分子量: 231.04

InChI:InChI=1S/C8H7BrO3/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5H2,(H,10,11)

InChIKey: SZEBGAQWWSUOHT-UHFFFAOYSA-N

Smiles:C(O)(=O)COC1=CC=C(Br)C=C1

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    Mass

    MS2005-02810WA      
    (p-bromophenoxy)acetic acid
    C8H7BrO3            (Mass of molecular ion:    230)
    

       Source Temperature: 250 °C
       Sample Temperature:  20 °C
       Direct, 70 eV
    

          18.0       2.2
          31.0       1.7
          37.0       1.2
          38.0       4.0
          39.0       2.7
          42.0       1.1
          45.0       1.2
          50.0      11.0
          51.0       3.3
          53.0       1.1
          61.0       1.4
          62.0       3.6
          63.0      11.9
          64.0       7.2
          65.0       4.6
          73.0       1.1
          74.0       6.1
          75.0      16.0
          76.0      17.1
          77.0       9.5
          78.0       7.8
          79.0       1.3
          92.0       5.5
          93.0       3.8
          94.0       1.0
         106.0       4.3
         117.0       2.5
         119.0       2.5
         143.0      15.1
         144.0       1.2
         145.0      14.7
         155.0      31.6
         156.0       2.7
         157.0      35.2
         158.0       2.7
         159.0       4.9
         171.0      12.7
         172.0      29.1
         173.0      14.1
         174.0      27.8
         175.0       1.8
         185.0      46.6
         186.0       3.8
         187.0      45.4
         188.0       3.6
         230.0     100.0
         231.0       9.4
         232.0      98.4
         233.0       8.6
    

in CDCl3

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in CDCl3

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KBr disc

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nujol mull

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