Tyramine(51-67-2) IR1

Product NameTyramine

CAS 51-67-2

Molecular FormulaC8H11NO

Molecular Weight137.18

InChIInChI=1S/C8H11NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5-6,9H2

InChIKey DZGWFCGJZKJUFP-UHFFFAOYSA-N

SmilesC1(O)=CC=C(CCN)C=C1

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Mass

MS-NW-4732          
p-(2-aminoethyl)phenol
C8H11NO             (Mass of molecular ion:    137)

   Source Temperature: 200 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      18.0       3.7
      27.0       2.2
      28.0       5.4
      30.0     100.0
      31.0       1.7
      32.0       1.2
      39.0       3.5
      42.0       1.0
      50.0       1.5
      51.0       3.4
      52.0       2.1
      53.0       2.4
      55.0       1.2
      63.0       1.5
      65.0       1.7
      77.0       8.9
      78.0       2.8
      79.0       2.2
      80.0       1.1
      90.0       1.1
      91.0       2.6
     106.0       1.1
     107.0      26.3
     108.0      47.6
     109.0       3.9
     120.0       1.3
     137.0       8.2

400 MHz in DMSO-d6

¹H NMR	399.65 MHz
C₈ H₁₁ N O	0.046 g : 0.5 ml DMSO-d₆
p-(2-aminoethyl)phenol

    Assign.     Shift(ppm)

      A             6.972
      B             6.682
      C             4.14
      D             2.703
      E             2.53
     
     SIGNAL E OVERLAPPED BY SOLVENT AT 2.5 PPM.

     Hz     ppm     Int.

   2797.49   7.000     31
   2796.51   6.998     36
   2793.46   6.990    108
   2790.65   6.983    727
   2788.70   6.978    319
   2786.13   6.972     92
   2784.18   6.967    280
   2782.10   6.962    868
   2779.42   6.955    126
   2680.18   6.707     40
   2677.25   6.699    139
   2674.44   6.692   1000
   2672.49   6.688    374
   2669.80   6.681     90
   2669.56   6.680     90
   2668.09   6.677    292
   2666.02   6.671    900
   2663.21   6.664    112
   1652.71   4.136    122
   1087.89   2.723    360
   1081.18   2.706    772
   1079.96   2.703    463
   1073.36   2.686    540
   1017.82   2.547    470
   1010.25   2.528    627
   1006.47   2.519    118
   1003.42   2.511    592

KBr disc