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返回ChemicalBook首頁>CAS數(shù)據(jù)庫列表>2807-30-9更多圖譜> 乙二醇單正丙醚(2807-30-9)質(zhì)譜(MS)

2807-30-9

乙二醇單正丙醚(2807-30-9)質(zhì)譜(MS)

產(chǎn)品名稱:乙二醇單正丙醚

CAS:2807-30-9

分子式:C5H12O2

分子量: 104.15

InChI:InChI=1S/C5H12O2/c1-2-4-7-5-3-6/h6H,2-5H2,1H3

InChIKey: YEYKMVJDLWJFOA-UHFFFAOYSA-N

Smiles:C(O)COCCC

  • 圖譜
    Mass 

    MS-KW-0412          
2-propoxyethanol
C5H12O2             (Mass of molecular ion:    104)


       Source Temperature: 240 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV


          15.0       1.5
      19.0       2.0
      27.0      12.7
      28.0       1.3
      29.0       3.8
      31.0      10.8
      39.0       3.3
      41.0      20.3
      42.0       5.4
      43.0     100.0
      44.0       4.7
      45.0      38.9
      46.0       1.0
      55.0       3.8
      57.0       3.0
      58.0       2.9
      59.0       2.5
      61.0       1.2
      73.0      25.4
      74.0       1.3
      75.0       6.3
      86.0      11.0

400 MHz in CDCl3

  • 圖譜

    1H NMR 399.65 MHz
    C5H12O2 0.05 ml : 0.5 ml CDCl3
    2-propoxyethanol
    ChemicalStructure 
        Assign.     Shift(ppm)
    
     A           3.722
     B           3.537
     C           3.441
     D           3.08
     E           1.618
     F           0.929
  

         Hz     ppm     Int.


       1492.68   3.734    195
   1488.29   3.723    262
   1483.40   3.711    217
   1417.97   3.547    497
   1416.02   3.542    132
   1414.31   3.538    275
   1413.09   3.535    413
   1410.77   3.529    103
   1408.57   3.524    355
   1382.21   3.458    426
   1375.37   3.441    729
   1368.54   3.424    421
   1231.57   3.081     84
    664.80   1.663     62
    657.35   1.645    194
    650.52   1.628    352
    643.19   1.609    356
    636.24   1.592    198
    628.91   1.574     63
    378.30   0.947    622
    370.98   0.928   1000
    363.41   0.910    542

in CDCl3

  • 圖譜

liquid film

  • 圖譜

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