4-NITROPHENYL LAURATE(1956-11-2) MS

Product Name4-NITROPHENYL LAURATE

CAS 1956-11-2

Molecular FormulaC18H27NO4

Molecular Weight321.41

InChIInChI=1S/C18H27NO4/c1-2-3-4-5-6-7-8-9-10-11-18(20)23-17-14-12-16(13-15-17)19(21)22/h12-15H,2-11H2,1H3

InChIKey YNGNVZFHHJEZKD-UHFFFAOYSA-N

SmilesC(OC1=CC=C([N+]([O-])=O)C=C1)(=O)CCCCCCCCCCC

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4-NITROPHENYL LAURATE(1956-11-2) MS
Mass

MS-NW-2234          
p-nitrophenyl laurate
C18H27NO4           (Mass of molecular ion:    321)

   Source Temperature: 170 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      27.0       3.9
      28.0       1.1
      29.0       8.5
      30.0       1.6
      39.0       3.1
      41.0      16.2
      42.0       4.3
      43.0      33.6
      44.0       1.0
      53.0       1.1
      54.0       1.0
      55.0      14.8
      56.0       3.1
      57.0      51.9
      58.0       2.3
      63.0       1.3
      64.0       1.1
      65.0       1.9
      67.0       4.0
      68.0       1.0
      69.0       6.9
      70.0       1.3
      71.0      26.2
      72.0       1.4
      81.0       5.6
      83.0       8.9
      84.0       2.9
      85.0      18.9
      86.0       1.2
      93.0       1.0
      95.0      12.4
      96.0       1.1
      97.0       4.3
      98.0       3.3
      99.0       3.3
     109.0       8.3
     113.0       1.1
     123.0       2.6
     139.0       1.1
     140.0       1.2
     181.0       2.1
     183.0     100.0
     184.0      13.0
     185.0       1.1

in CDCl3