2,5-Dimethylphenol(95-87-4) ¹H NMR

Product Name2,5-Dimethylphenol

CAS 95-87-4

Molecular FormulaC8H10O

Molecular Weight122.16

InChIInChI=1S/C8H10O/c1-6-3-4-7(2)8(9)5-6/h3-5,9H,1-2H3

InChIKey NKTOLZVEWDHZMU-UHFFFAOYSA-N

SmilesC1(O)=CC(C)=CC=C1C

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Mass

MS-NW-1850          
2,5-xylenol
C8H10O              (Mass of molecular ion:    122)

   Source Temperature: 260 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      18.0       2.1
      26.0       1.0
      27.0       9.1
      28.0       4.1
      37.0       1.0
      38.0       3.1
      39.0      15.9
      40.0       2.1
      41.0       5.3
      43.0       3.4
      45.0       1.2
      50.0       5.6
      51.0      13.2
      52.0       4.9
      53.0       7.8
      55.0       2.4
      60.0       2.7
      61.0       1.9
      62.0       1.9
      63.0       4.9
      64.0       1.1
      65.0       8.0
      66.0       1.7
      67.0       1.3
      74.0       1.4
      75.0       1.1
      77.0      30.3
      78.0      10.7
      79.0      18.7
      80.0       1.7
      89.0       1.3
      91.0      18.7
      92.0       2.7
      93.0       5.7
      94.0       3.7
     102.0       1.0
     103.0       7.1
     104.0       7.6
     105.0       3.7
     107.0      91.0
     108.0       7.0
     121.0      41.2
     122.0     100.0
     123.0       8.7