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121-79-9

没食子酸丙酯(121-79-9)核磁图(13CNMR)

产品名称:没食子酸丙酯

CAS:121-79-9

分子式:C10H12O5

分子量: 212.2

InChI:InChI=1S/C10H12O5/c1-2-3-15-10(14)6-4-7(11)9(13)8(12)5-6/h4-5,11-13H,2-3H2,1H3

InChIKey: ZTHYODDOHIVTJV-UHFFFAOYSA-N

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

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    Mass

    MS-NW-1164          
    propyl gallate
    C10H12O5            (Mass of molecular ion:    212)
    

       Source Temperature: 230 °C
       Sample Temperature: 140 °C
       Direct, 75 eV
    

          18.0       1.2
          27.0       5.5
          28.0       3.6
          29.0       1.7
          31.0       1.1
          38.0       1.7
          39.0       6.8
          40.0       2.1
          41.0       5.4
          43.0       2.5
          50.0       3.1
          51.0       7.0
          52.0       1.0
          53.0       3.3
          55.0       1.4
          66.0       1.2
          67.0       2.1
          68.0       2.5
          69.0       1.2
          77.0       1.2
          78.0       3.4
          79.0      10.7
          80.0       1.1
          97.0       1.6
         107.0       4.2
         108.0       1.2
         113.0       2.5
         124.0       3.7
         125.0      16.1
         126.0       5.9
         135.0       1.1
         141.0       1.7
         152.0       3.4
         153.0     100.0
         154.0      11.0
         155.0       1.4
         169.0       2.3
         170.0      79.1
         171.0       6.5
         172.0       1.1
         183.0       4.4
         211.0       1.8
         212.0      41.2
         213.0       4.8
    

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in D2O

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KBr disc

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nujol mull

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