95-47-6

o-Xylene(95-47-6) Raman

Product Nameo-Xylene

CAS 95-47-6

Molecular FormulaC8H10

Molecular Weight106.17

InChIInChI=1S/C8H10/c1-7-5-3-4-6-8(7)2/h3-6H,1-2H3

InChIKey CTQNGGLPUBDAKN-UHFFFAOYSA-N

SmilesC1(C)=CC=CC=C1C

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o-Xylene(95-47-6) Raman
Mass

MS-NW-0046          
o-xylene
C8H10               (Mass of molecular ion:    106)

   Source Temperature: 230 °C
   Sample Temperature:  55 °C
   Reservoir, 75 eV

      27.0       2.9
      38.0       1.1
      39.0       7.6
      41.0       1.9
      43.0       1.3
      50.0       3.6
      51.0       8.2
      52.0       3.5
      53.0       2.2
      62.0       1.6
      63.0       4.6
      65.0       6.4
      74.0       1.4
      75.0       1.0
      77.0      10.9
      78.0       5.7
      79.0       6.5
      89.0       1.9
      91.0     100.0
      92.0       8.0
     102.0       1.3
     103.0       5.8
     104.0       2.9
     105.0      26.4
     106.0      63.3
     107.0       5.7

400 MHz in CDCl3

o-Xylene(95-47-6) Raman

¹H NMR	399.65 MHz
C₈ H₁₀	0.05 ml : 0.5 ml CDCl₃
o-xylene

    Assign.     Shift(ppm)

      A             7.07
      B             2.220

     Hz     ppm     Int.

   2839.60   7.106     50
   2835.33   7.095     94
   2830.08   7.082    199
   2825.93   7.072    262
   2823.49   7.065     97
   2820.92   7.059    105
   2816.89   7.049     73
    887.33   2.221   1000
    879.39   2.201     36

in CDCl3