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

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626-22-2

1,3-苯二乙腈(626-22-2)核磁圖(1HNMR)

產(chǎn)品名稱:1,3-苯二乙腈

CAS:626-22-2

分子式:C10H8N2

分子量: 156.18

InChI:InChI=1S/C10H8N2/c11-6-4-9-2-1-3-10(8-9)5-7-12/h1-3,8H,4-5H2

InChIKey: GRPFZJNUYXIVSL-UHFFFAOYSA-N

Smiles:C1(CC#N)=CC=CC(CC#N)=C1

  • 圖譜
    Mass 

    MS-IW-0278          
m-phenylenediacetonitrile
C10H8N2             (Mass of molecular ion:    156)


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


          27.0       1.1
      38.0       1.4
      39.0       4.4
      50.0       3.3
      51.0       5.9
      52.0       1.6
      62.0       2.4
      63.0       5.6
      64.0       2.9
      64.5       1.1
      65.0       1.4
      74.0       1.2
      75.0       2.7
      76.0       2.9
      77.0       5.5
      78.0       1.5
      87.0       1.0
      88.0       1.6
      89.0      11.3
      90.0       2.0
      91.0       1.0
     101.0       4.2
     102.0       6.7
     103.0       5.5
     104.0       1.0
     116.0     100.0
     117.0       9.3
     127.0       1.7
     128.0       7.2
     129.0      13.7
     130.0      12.5
     131.0       1.5
     155.0       2.4
     156.0      34.7
     157.0       4.2
     164.0       2.9
     165.0       2.5
     166.0       1.4
     167.0       1.0

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in CDCl3

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KBr disc

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nujol mull

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