3-Methoxyphenol(150-19-6) IR1

Product Name3-Methoxyphenol

CAS 150-19-6

Molecular FormulaC7H8O2

Molecular Weight124.14

InChIInChI=1S/C7H8O2/c1-9-7-4-2-3-6(8)5-7/h2-5,8H,1H3

InChIKey ASHGTJPOSUFTGB-UHFFFAOYSA-N

SmilesC1(O)=CC=CC(OC)=C1

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Mass

MS-NW-8343          
m-methoxyphenol
C7H8O2              (Mass of molecular ion:    124)

   Source Temperature: 250 °C
   Sample Temperature: 140 °C
   Reservoir, 75 eV

      15.0       1.8
      26.0       1.7
      27.0       9.0
      28.0       2.1
      29.0       2.3
      37.0       1.9
      38.0       5.3
      39.0      14.7
      40.0       3.5
      41.0       4.1
      42.0       1.5
      43.0       1.2
      50.0       4.0
      51.0       6.1
      52.0       6.8
      53.0      20.2
      54.0       1.7
      55.0       5.9
      61.0       1.4
      62.0       3.4
      63.0       6.5
      64.0       2.9
      65.0      10.6
      66.0      19.6
      67.0       3.2
      68.0       2.2
      69.0       6.0
      77.0       4.1
      78.0       2.2
      79.0       1.9
      80.0       2.1
      81.0      32.9
      82.0       1.9
      93.0       3.5
      94.0      53.7
      95.0      29.2
      96.0       2.2
     105.0       1.0
     107.0       1.2
     108.0       1.2
     109.0       2.2
     123.0       3.1
     124.0     100.0
     125.0       7.8
     138.0       1.6

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₇ H₈ O₂	0.04 ml : 0.5 ml CDCl₃
m-methoxyphenol

    Assign.     Shift(ppm)

      A             7.107
      B             6.48
      C             6.43
      D             6.41
      E             5.64
      F             3.747

     Hz     ppm     Int.

    645.75   7.211     56
    637.81   7.122     75
    637.13   7.115     76
    629.06   7.024     91
    587.19   6.557     38
    586.06   6.544     56
    584.94   6.532     53
    583.88   6.520     79
    581.31   6.491     44
    580.19   6.479     48
    578.88   6.464    113
    577.81   6.452     89
    576.38   6.436    149
    574.13   6.411    177
    572.56   6.394    103
    571.88   6.386     92
    571.38   6.380     86
    570.38   6.369     38
    505.19   5.641     63
    335.69   3.749   1000

in CDCl3