596-38-3

9-苯基苯二烯-9-醇(596-38-3)核磁图(¹HNMR)

产品名称:9-苯基苯二烯-9-醇

CAS:596-38-3

分子式:C19H14O2

分子量: 274.31

InChI:InChI=1S/C19H14O2/c20-19(14-8-2-1-3-9-14)15-10-4-6-12-17(15)21-18-13-7-5-11-16(18)19/h1-13,20H

InChIKey: CVZUPKFPOSRRSK-UHFFFAOYSA-N

Smiles:C1(C2=CC=CC=C2)(O)C2=C(C=CC=C2)OC2=C1C=CC=C2

Mass

MS-NW-7154          
9-phenyl-9-xanthenol
C19H14O2            (Mass of molecular ion:    274)

   Source Temperature: 170 °C
   Sample Temperature: 130 °C
   Direct, 75 eV

      18.0       3.0
      39.0       1.8
      50.0       1.4
      51.0       4.3
      63.0       1.9
      65.0       1.3
      75.0       1.4
      76.0       1.2
      77.0       6.5
      88.0       1.0
      92.0       1.1
     100.0       1.5
     101.0       1.3
     113.0       2.7
     115.0       4.8
     121.0       1.6
     127.5       1.5
     128.0       1.7
     137.0       1.7
     139.0       3.2
     141.0       3.4
     152.0       1.5
     168.0       2.6
     181.0       3.8
     196.0       3.5
     197.0     100.0
     198.0      14.5
     199.0       1.7
     202.0       1.1
     226.0       2.3
     227.0       1.0
     228.0       1.4
     243.0       1.2
     255.0       5.8
     256.0       2.1
     257.0      13.7
     258.0       4.2
     274.0       8.2
     275.0       1.8

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₉ H₁₄ O₂	0.038 g : 0.5 ml CDCl₃
9-phenyl-9-xanthenol

    Assign.     Shift(ppm)

      A             7.385
      B             7.340
      C             7.28
      D             7.26
      E             7.18
      F             7.17
      G             7.042
      J             2.66

     Hz     ppm     Int.

   2956.30   7.398    466
   2955.08   7.395    551
   2953.00   7.389    147
   2948.73   7.379    528
   2947.88   7.377    770
   2944.58   7.368     86
   2938.11   7.352    572
   2937.74   7.351    549
   2936.52   7.348    594
   2930.30   7.333    648
   2928.71   7.329    666
   2916.99   7.299    314
   2916.26   7.298    192
   2915.41   7.295    261
   2909.79   7.281    844
   2908.69   7.279    705
   2908.20   7.277    602
   2907.10   7.275    433
   2902.59   7.263    962
   2901.61   7.261    797
   2900.02   7.257    473
   2896.24   7.247    278
   2894.78   7.244    410
   2892.70   7.239     82
   2890.87   7.234    448
   2890.01   7.232    755
   2872.31   7.188   1000
   2871.46   7.185    802
   2868.16   7.177    178
   2866.58   7.173    405
   2864.14   7.167    688
   2863.16   7.165    513
   2860.11   7.157    123
   2858.89   7.154    144
   2857.67   7.151     69
   2821.17   7.060    514
   2819.95   7.057    395
   2817.14   7.050     43
   2814.09   7.042    683
   2813.35   7.040    692
   2812.13   7.037    388
   2810.18   7.032     42
   2809.33   7.030     36
   2808.72   7.028     37
   2806.27   7.022    391
   2804.93   7.019    300
   1062.38   2.659    822

in CDCl3