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108-23-6

氯甲酸異丙酯(108-23-6)質(zhì)譜(MS)

產(chǎn)品名稱:氯甲酸異丙酯

CAS:108-23-6

分子式:C4H7ClO2

分子量: 122.55

InChI:InChI=1S/C4H7ClO2/c1-3(2)7-4(5)6/h3H,1-2H3

InChIKey: IVRIRQXJSNCSPQ-UHFFFAOYSA-N

Smiles:C(Cl)(OC(C)C)=O

  • 圖譜
    Mass 

    MS-IW-3408          
isopropyl chloroformate
C4H7ClO2            (Mass of molecular ion:    122)


       Source Temperature: 220 °C
   Sample Temperature: 160 °C
   Reservoir, 75 eV


          14.0       1.0
      15.0       5.2
      26.0       2.4
      27.0      22.3
      28.0       3.3
      29.0       4.1
      35.0       2.1
      36.0       1.8
      37.0       1.7
      38.0       2.8
      39.0      12.2
      40.0       3.4
      41.0      39.8
      42.0      30.4
      43.0      98.3
      44.0       8.6
      45.0       1.7
      59.0       1.2
      63.0     100.0
      64.0       1.4
      65.0      38.9
      78.0       1.1
     107.0      63.6
     108.0       2.3
     109.0      21.0

parameter in CDCl3

  • 圖譜

    1H NMR 300 MHz
    C4 H7 Cl O2 0.05 ml : 0.5 ml CDCl3
    isopropyl chloroformate
    ChemicalStructure 
        Parameter     ppm  Hz
    
      D(A)         5.079
      D(B)         1.381
       J(A,B)          6.35
  

         Hz     ppm     Int.


       1536.48   5.122     31
   1530.12   5.100     76
   1523.75   5.079    101
   1517.39   5.058     78
   1511.06   5.037     32
    417.49   1.392   1000
    411.13   1.370    991

in CDCl3

  • 圖譜

liquid film

  • 圖譜

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