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112-02-7

西曲氯铵(112-02-7)核磁图(13CNMR)

产品名称:西曲氯铵

CAS:112-02-7

分子式:C19H42ClN

分子量: 320

InChI:InChI=1S/C19H42N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;/h5-19H2,1-4H3;1H/q+1;/p-1

InChIKey: WOWHHFRSBJGXCM-UHFFFAOYSA-M

Smiles:C(CC[N+](C)(C)C)CCCCCCCCCCCCC.[Cl-]

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    Mass

    MS-NW-8248          
    hexadecyltrimethylammonium chloride
    C19H42ClN           (Mass of molecular ion:    319)
    

       Source Temperature: 190 °C
       Sample Temperature: 210 °C
       Direct, 75 eV
    

          29.0       1.4
          41.0       2.7
          42.0       1.4
          43.0       4.3
          44.0       1.3
          45.0       1.4
          46.0       1.0
          50.0       2.9
          55.0       2.6
          57.0       3.2
          58.0     100.0
          59.0       4.1
          69.0       1.3
          71.0       1.4
          84.0       1.1
         268.0       1.1
         269.0       1.6
    

in CDCl3

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KBr disc

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nujol mull

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