1-Phenacylpyridinium bromide(16883-69-5) ¹H NMR

Product Name1-Phenacylpyridinium bromide

CAS 16883-69-5

Molecular FormulaC13H12BrNO

Molecular Weight278.14

InChIInChI=1S/C13H12NO.BrH/c15-13(12-7-3-1-4-8-12)11-14-9-5-2-6-10-14;/h1-10H,11H2;1H/q+1;/p-1

InChIKey PXSUMUYPXZEXDT-UHFFFAOYSA-M

SmilesC1(C=CC=CC=1)C(=O)C[N+]1=CC=CC=C1.[Br-]

Request For Quotation

400 MHz in DMSO-d6

¹H NMR	399.65 MHz
C₁₃ H₁₂ Br N O	0.040 g : 0.5 ml DMSO-d₆
1-phenacylpyridinium bromide

    Assign.     Shift(ppm)

      A             9.126
      B             8.772
      C             8.318
      D             8.093
      E             7.804
      F             7.676
      G             6.660

     Hz     ppm     Int.

   3650.05   9.134    436
   3644.56   9.120    446
   3515.47   8.797     75
   3514.10   8.793    142
   3512.73   8.790     89
   3507.54   8.777    157
   3506.32   8.774    294
   3504.94   8.771    171
   3499.76   8.758     99
   3498.38   8.754    172
   3497.01   8.751    100
   3331.30   8.336    336
   3324.58   8.319    418
   3323.52   8.317    411
   3318.48   8.304    139
   3316.80   8.300    314
   3239.14   8.105    391
   3237.92   8.102    521
   3232.73   8.089    155
   3230.74   8.084    571
   3229.52   8.081    508
   3128.81   7.829     66
   3127.59   7.826    132
   3126.37   7.823     88
   3122.10   7.813     96
   3120.27   7.808    307
   3118.44   7.803    132
   3114.01   7.792    134
   3112.79   7.789    235
   3111.57   7.786    136
   3075.71   7.697    386
   3074.34   7.693    192
   3067.78   7.677    573
   3062.13   7.663    110
   3060.46   7.658    283
   3059.84   7.657    226
   2662.05   6.661   1000

in DMSO-d6

in D2O