Diphenyl(4-pyridyl)methanol(1620-30-0) ¹³C NMR

Product NameDiphenyl(4-pyridyl)methanol

CAS 1620-30-0

Molecular FormulaC18H15NO

Molecular Weight261.32

InChIInChI=1S/C18H15NO/c20-18(15-7-3-1-4-8-15,16-9-5-2-6-10-16)17-11-13-19-14-12-17/h1-14,20H

InChIKey MRHLFZXYRABVOZ-UHFFFAOYSA-N

SmilesC(O)(C1=CC=NC=C1)(C1C=CC=CC=1)C1=CC=CC=C1

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Mass

MS-NW-7747          
alpha,alpha-diphenyl-4-pyridinemethanol
C18H15NO            (Mass of molecular ion:    261)

   Source Temperature: 180 °C
   Sample Temperature: 130 °C
   Direct, 75 eV

      27.0       2.1
      28.0       1.9
      39.0       3.7
      45.0       1.0
      50.0       5.6
      51.0      27.1
      52.0       5.0
      53.0       1.6
      62.0       1.4
      63.0       3.6
      65.0       1.1
      74.0       2.0
      75.0       2.6
      76.0       3.7
      77.0      63.1
      78.0      35.8
      79.0      36.4
      80.0       4.9
      87.0       1.7
      88.0       1.2
      89.0       1.7
      91.0       1.9
      94.5       1.5
     101.0       1.6
     102.0       1.5
     104.0       1.0
     105.0     100.0
     106.0      44.9
     106.5       1.1
     107.0       5.2
     113.0       1.1
     115.0       2.3
     121.5       1.0
     126.0       1.6
     127.0       3.4
     128.0       2.7
     139.0       3.6
     140.0       1.5
     151.0       1.1
     152.0       3.3
     153.0       1.8
     154.0       3.8
     155.0       8.8
     156.0      15.2
     157.0       2.1
     163.0       1.3
     164.0       1.1
     165.0       5.7
     166.0       3.3
     167.0       4.9
     168.0       1.4
     181.0       1.8
     182.0       4.1
     183.0      94.1
     184.0      36.0
     185.0       4.8
     189.0       1.7
     202.0       1.4
     213.0       1.7
     214.0       1.0
     215.0       2.4
     216.0       1.0
     240.0       1.0
     241.0       2.2
     242.0       2.8
     243.0       4.9
     244.0       3.7
     245.0       4.2
     246.0       1.0
     258.0       1.0
     259.0       1.8
     260.0       5.3
     261.0      58.9
     262.0      12.6
     263.0       1.7

400 MHz in DMSO-d6 at 60C

¹H NMR	399.65 MHz
C₁₈ H₁₅ N O	0.026 g : 0.5 ml DMSO-d₆ at 60 C
alpha,alpha-diphenyl-4-pyridinemethanol

    Assign.     Shift(ppm)

      A             8.504
      B             7.31
      C             7.27
      D             7.24
      E             7.21
      F             6.57

     Hz     ppm     Int.

   3400.63   8.510    182
   3395.75   8.497    182
   2943.85   7.367     33
   2943.48   7.366     34
   2942.63   7.364     36
   2939.09   7.355     73
   2933.47   7.341    181
   2931.88   7.337    274
   2930.18   7.332    184
   2925.05   7.320    646
   2923.34   7.315    420
   2918.95   7.304    324
   2917.60   7.301    650
   2911.13   7.285    217
   2909.55   7.281    371
   2908.08   7.277    303
   2905.03   7.269    169
   2902.47   7.263    397
   2899.41   7.255    147
   2894.41   7.243    404
   2890.75   7.234    781
   2889.16   7.230   1000
   2884.03   7.217    321
   2882.32   7.213    523
   2881.10   7.210    419
   2875.37   7.195     32
   2626.83   6.573    295

DMSO-d6