1HNMR)的核磁圖,紅外圖譜,Raman光譜,質(zhì)譜等圖譜" /> 1HNMR)" />

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78-83-1

異丁醇(78-83-1)核磁圖(1HNMR)

產(chǎn)品名稱:異丁醇

CAS:78-83-1

分子式:C4H10O

分子量: 74.12

InChI:InChI=1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3

InChIKey: ZXEKIIBDNHEJCQ-UHFFFAOYSA-N

Smiles:C(O)C(C)C

  • 圖譜
    Mass 

    MS-NW-0099          
2-methyl-1-propanol 
C4H10O              (Mass of molecular ion:     74)


       Source Temperature: 240 °C
   Sample Temperature:  95 °C
   Reservoir, 75 eV


          15.0       1.5
      18.0       3.4
      26.0       1.6
      27.0      23.0
      28.0      12.4
      29.0       8.0
      31.0      39.7
      32.0       3.6
      33.0      46.3
      38.0       2.1
      39.0      14.1
      40.0       2.8
      41.0      57.3
      42.0      59.4
      43.0     100.0
      44.0       3.2
      45.0       3.6
      55.0       5.5
      56.0       4.6
      57.0       2.8
      59.0       5.9
      73.0       3.1
      74.0      13.3

90 MHz in CDCl3

in CDCl3

  • 圖譜

    1H NMR 89.56 MHz
    C4 H10 O 0.04 ml : 0.5 ml CDCl3
    2-methyl-1-propanol
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             3.391
      B             2.07
      C             1.75
      D             0.920
     
     J(A,C)=6.5HZ. J(C,D)=6.4HZ.
  

         Hz     ppm     Int.


        307.06   3.429    500
    300.63   3.357    554
    186.31   2.081    121
    185.19   2.068    255
    164.56   1.838     44
    158.00   1.765     49
    157.63   1.761     48
    151.19   1.689     55
    144.69   1.616     40
     85.13   0.951   1000
     78.69   0.879    740

  • 圖譜

in CDCl3

  • 圖譜

CCl4 solution

  • 圖譜

liquid film

  • 圖譜

4880 A,100M,liquid

  • 圖譜

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