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580-16-5

6-羟基喹啉(580-16-5)质谱(MS)

产品名称:6-羟基喹啉

CAS:580-16-5

分子式:C9H7NO

分子量: 145.16

InChI:InChI=1S/C9H7NO/c11-8-3-4-9-7(6-8)2-1-5-10-9/h1-6,11H

InChIKey: OVYWMEWYEJLIER-UHFFFAOYSA-N

Smiles:N1C2C(=CC(O)=CC=2)C=CC=1

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    Mass

    MS-KW-0530          
    6-quinolinol
    C9H7NO              (Mass of molecular ion:    145)
    

       Source Temperature: 150 °C
       Sample Temperature: 120 °C
       Direct, 75 eV
    

          38.0       1.4
          39.0       2.9
          50.0       1.4
          51.0       1.7
          52.0       1.1
          53.0       1.1
          59.0       1.3
          62.0       2.5
          63.0       6.6
          64.0       2.4
          72.5       4.0
          89.0      10.3
          90.0      10.8
          91.0       1.5
         116.0       6.7
         117.0      11.6
         118.0       4.2
         119.0       1.4
         144.0       5.6
         145.0     100.0
         146.0      10.4
    

400 MHz in DMSO-d6

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    1H NMR 399.65 MHz
    C9H7NO 0.035 g : 0.5 ml DMSO-d6
    6-quinolinol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 10.05 B 8.673 C 8.144 D 7.886 E 7.406 F 7.338 G 7.167

         Hz     ppm     Int.
    

       4017.64  10.050    985
       3466.95   8.673    834
       3259.59   8.154    619
       3251.65   8.134    629
       3156.90   7.897    632
       3148.20   7.875    660
       2960.67   7.406    598
       2937.47   7.348    637
       2928.93   7.327    574
       2865.15   7.167   1000
    

in DMSO-d6

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KBr disk

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Nujol

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