13CNMR)的核磁圖,紅外圖譜,Raman光譜,質(zhì)譜等圖譜" /> 13CNMR)" />

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2498-20-6

四戊基碘化銨(2498-20-6)核磁圖(13CNMR)

產(chǎn)品名稱:四戊基碘化銨

CAS:2498-20-6

分子式:C20H44IN

分子量: 425.47

InChI:InChI=1S/C20H44N.HI/c1-5-9-13-17-21(18-14-10-6-2,19-15-11-7-3)20-16-12-8-4;/h5-20H2,1-4H3;1H/q+1;/p-1

InChIKey: FBLZDUAOBOMSNZ-UHFFFAOYSA-M

Smiles:[N+](CCCCC)(CCCCC)(CCCCC)CCCCC.[I-]

  • 圖譜
    Mass 

    MS-NW-9236          
tetrapentylammonium iodide
C20H44IN            (Mass of molecular ion:    425)


       Source Temperature: 240 °C
   Sample Temperature: 160 °C
   Direct, 75 eV


          17.0       1.0
      18.0       5.8
      27.0       5.5
      28.0       1.6
      29.0       9.5
      30.0       3.8
      39.0       3.0
      41.0      14.2
      42.0       5.3
      43.0      52.5
      44.0       7.7
      55.0       4.8
      56.0       1.4
      57.0       2.5
      58.0       6.7
      69.0       2.1
      70.0       1.4
      71.0      35.5
      72.0       2.1
      84.0       3.7
      98.0       1.1
     100.0       2.2
     112.0       2.6
     114.0      33.7
     115.0       2.8
     156.0       1.0
     168.0       1.1
     170.0     100.0
     171.0      12.5
     196.0       1.0
     198.0       6.8
     227.0       5.0

90 MHz in CDCl3

  • 圖譜

    1H NMR 89.56 MHz
    C20 H44 I N 0.038 g : 0.5 ml CDCl3
    tetrapentylammonium iodide
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             3.37
      B             1.72
      C          1.53 to 1.28
      D             0.93
  

         Hz     ppm     Int.


        310.25   3.465    210
    304.94   3.405    240
    304.25   3.398    244
    303.56   3.390    249
    303.13   3.385    247
    298.94   3.338    209
    298.56   3.334    209
    294.25   3.286    286
    144.31   1.612    197
    130.94   1.463    587
    128.06   1.430    594
    124.31   1.389    657
     88.75   0.991    381
     83.00   0.927   1000
     77.13   0.862    313

in CDCl3

  • 圖譜

KBr disc

  • 圖譜

nujol mull

  • 圖譜

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