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Back ChemicalBook Home>CAS DataBase List>52398-48-8More Spectrum> BETA,BETA-DIMETHYL-GAMMA-(HYDROXYMETHYL)-GAMMA-BUTYROLACTONE)(52398-48-8) IR1

BETA,BETA-DIMETHYL-GAMMA-(HYDROXYMETHYL)-GAMMA-BUTYROLACTONE)(52398-48-8) IR1

Molecular FormulaC7H12O3

Molecular Weight144.17


  • Mass

    MS-IW-2018          
    (+-)-beta,beta-dimethyl-gamma-hydroxymethyl-gamma-butyrolactone
    C7H12O3             (Mass of molecular ion:    144)
    

       Source Temperature: 230 °C
       Sample Temperature: 160 °C
       Reservoir, 75 eV
    

          15.0       3.3
          17.0       9.7
          18.0      48.8
          20.0       1.0
          27.0      10.9
          28.0      12.2
          29.0      24.7
          31.0       9.6
          32.0       2.2
          38.0       1.0
          39.0      13.3
          40.0       3.4
          41.0      54.3
          42.0       5.5
          43.0      45.0
          44.0       3.1
          45.0       3.1
          51.0       1.0
          53.0       2.9
          54.0       1.0
          55.0      12.7
          56.0      58.2
          57.0      27.1
          58.0       2.3
          59.0       5.1
          60.0       1.0
          67.0       8.9
          68.0       1.3
          69.0       6.0
          70.0       1.3
          71.0       6.4
          72.0       1.8
          73.0       1.0
          83.0       5.7
          84.0       1.7
          85.0      23.8
          86.0       2.5
          95.0      14.0
          96.0       1.3
         111.0       2.5
         113.0     100.0
         114.0       7.1
         116.0       1.9
         126.0       1.4
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C7 H12 O3 0.034 g : 0.5 ml CDCl3
    (+-)-beta,beta-dimethyl-gamma-hydroxymethyl-gamma-butyrolactone
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.182 B *1 3.83 C *1 3.81 D 3.03 E *2 2.499 F *2 2.354 G *3 1.221 J *3 1.136

         Hz     ppm     Int.
    

       1675.90   4.194    118
       1672.24   4.185    126
       1670.65   4.181    144
       1666.99   4.172    128
       1537.60   3.848     25
       1528.56   3.825    188
       1527.34   3.822    210
       1525.15   3.817    155
       1521.97   3.809    160
       1514.77   3.791     20
       1509.40   3.777     21
       1211.30   3.031     35
       1009.40   2.526    166
        992.43   2.484    277
        947.14   2.370    290
        930.05   2.328    173
        487.92   1.221   1000
        464.23   1.162     23
        454.10   1.137    972
    

in CDCl3



KBr disc



nujol mull



BETA,BETA-DIMETHYL-GAMMA-(HYDROXYMETHYL)-GAMMA-BUTYROLACTONE)(52398-48-8) IR1 Atlas of Related Products

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