58743-81-0

對溴丙基聯(lián)苯(58743-81-0)核磁圖(¹HNMR)

產(chǎn)品名稱:對溴丙基聯(lián)苯

CAS:58743-81-0

分子式:C15H15Br

分子量: 275.18

InChI:InChI=1S/C15H15Br/c1-2-3-12-4-6-13(7-5-12)14-8-10-15(16)11-9-14/h4-11H,2-3H2,1H3

InChIKey: DPERLOMMOVDOHH-UHFFFAOYSA-N

Smiles:C1(C2=CC=C(CCC)C=C2)=CC=C(Br)C=C1

Mass

MS-NW-9390          
4-bromo-4'-propylbiphenyl
C15H15Br            (Mass of molecular ion:    274)

   Source Temperature: 160 °C
   Sample Temperature: 100 °C
   Direct, 75 eV

      18.0       3.2
      27.0       1.4
      39.0       2.0
      41.0       1.3
      50.0       1.0
      51.0       1.6
      63.0       2.8
      65.0       1.0
      69.5       1.4
      70.0       1.3
      75.0       2.0
      76.0       3.8
      77.0       1.3
      81.5       1.3
      82.0       5.3
      82.5       3.5
      83.0       2.5
      88.0       1.8
      89.0       2.9
     114.0       1.1
     115.0       3.3
     126.0       1.2
     127.0       1.0
     139.0       3.7
     150.0       1.2
     151.0       2.5
     152.0       6.5
     153.0       2.4
     163.0       3.4
     164.0       4.7
     165.0      50.9
     166.0      13.3
     167.0       3.4
     178.0       4.0
     179.0       1.7
     180.0       1.1
     191.0       1.0
     194.0       1.1
     232.0       1.0
     245.0      99.4
     246.0      14.7
     247.0     100.0
     248.0      14.2
     274.0      65.9
     275.0      11.6
     276.0      63.5
     277.0      10.9

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₅ H₁₅ Br	0.038 g : 0.5 ml CDCl₃
4-bromo-4'-propylbiphenyl

    Assign.     Shift(ppm)

      A             7.525
      B             7.45
      C             7.43
      D             7.236
      E             2.614
      F             1.666
      G             0.964

     Hz     ppm     Int.

   3015.26   7.545     50
   3012.82   7.539    437
   3012.33   7.538    332
   3010.74   7.534    161
   3006.23   7.523    184
   3004.03   7.517    693
   3001.59   7.511    105
   2985.72   7.471     58
   2983.76   7.466    384
   2981.81   7.462    145
   2977.29   7.450    163
   2975.34   7.445    555
   2973.14   7.440    706
   2970.95   7.434    209
   2966.43   7.423    158
   2964.36   7.418    467
   2961.91   7.412     61
   2898.56   7.253     68
   2896.61   7.248    408
   2896.12   7.247    369
   2894.65   7.243    142
   2890.14   7.232    126
   2888.18   7.227    370
   1052.61   2.634    200
   1045.17   2.616    260
   1037.23   2.596    217
    684.94   1.714     37
    677.61   1.696    147
    670.04   1.677    226
    663.82   1.662    105
    662.48   1.658    242
    656.49   1.643     43
    654.91   1.639    154
    647.71   1.621     41
    392.46   0.983    503
    385.13   0.964   1000
    377.69   0.946    450

in CDCl3