2-氨基-9-芴酮(3096-57-9)紅外圖譜(IR1)
InChI:InChI=1S/C13H9NO/c14-8-5-6-10-9-3-1-2-4-11(9)13(15)12(10)7-8/h1-7H,14H2
InChIKey: SJODITPGMMSNRF-UHFFFAOYSA-N
Smiles:C1(=O)C2=C(C=CC=C2)C2=C1C=C(N)C=C2
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Mass
MS-NW-6343
2-amino-9-fluorenone
C13H9NO (Mass of molecular ion: 195)
Source Temperature: 190 °C
Sample Temperature: 140 °C
Direct, 75 eV
39.0 1.1
62.0 1.3
63.0 2.3
69.5 2.5
70.0 1.3
70.5 2.4
74.0 1.2
75.0 1.2
82.5 1.7
83.5 6.1
86.0 1.0
87.0 1.4
89.0 1.3
97.5 2.8
113.0 1.7
114.0 1.1
115.0 1.1
138.0 1.5
139.0 14.6
140.0 6.3
141.0 1.1
150.0 1.1
164.0 1.1
166.0 5.2
167.0 6.1
168.0 3.2
194.0 2.3
195.0 100.0
196.0 14.7
197.0 1.3
400 MHz in CDCl3
90 MHz in CDCl3
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| 1H NMR |
399.65 MHz |
| C13 H9 N O
|
saturated in CDCl3
|
| 2-amino-9-fluorenone
|
 |
Assign. Shift(ppm)
A 7.549
B 7.382
C 7.320
D 7.252
E 7.133
F 6.957
G 6.709
J 3.91
J(A,B) = 1.2 HZ,
J(A,E) = 7.3 HZ,
J(B,C) = 7.5 HZ,
J(C,E) = 1.0 HZ,
J(D,G) = 7.9 HZ,
J(F,G) = 2.2 HZ.
|
Hz ppm Int.
3021.61 7.561 406
3020.87 7.559 570
3020.02 7.557 435
3014.28 7.543 443
3013.55 7.541 619
2959.35 7.405 243
2958.13 7.402 254
2956.18 7.397 43
2951.90 7.387 643
2950.68 7.384 655
2947.75 7.376 48
2947.39 7.375 47
2944.46 7.368 487
2943.24 7.365 478
2935.18 7.345 35
2933.72 7.341 32
2928.71 7.329 544
2927.98 7.327 824
2924.07 7.317 57
2923.46 7.316 55
2921.26 7.310 348
2920.53 7.308 488
2902.22 7.262 985
2898.19 7.252 61
2897.83 7.251 61
2894.29 7.243 961
2890.50 7.233 36
2860.47 7.158 36
2857.79 7.151 398
2856.81 7.149 393
2854.13 7.142 48
2850.46 7.133 682
2849.37 7.130 679
2843.02 7.114 320
2842.04 7.112 313
2781.49 6.960 943
2779.30 6.955 1000
2686.16 6.722 677
2683.84 6.716 651
2678.22 6.702 634
2675.90 6.696 608
1562.74 3.911 138
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| 1H NMR |
89.56 MHz |
| C13 H9 N O
|
0.049 g : 0.5 ml CDCl3
|
| 2-amino-9-fluorenone
|
|
Assign. Shift(ppm)
A 7.54
B 7.38
C 7.32
D 7.25
E 7.13
F 6.95
G 6.70
J 3.89
B,C AND E WERE CONFIRMED BY LAOCN PROGRAM.
400MHZ : HSP-41-745
|
Hz ppm Int.
679.75 7.590 310
676.76 7.557 111
676.33 7.552 107
672.49 7.509 452
667.36 7.452 95
666.33 7.441 90
662.92 7.402 281
661.72 7.389 291
655.74 7.322 1000
653.52 7.298 625
650.78 7.267 369
650.27 7.261 361
645.14 7.204 795
638.56 7.130 264
637.96 7.124 271
636.34 7.106 234
633.09 7.069 103
631.73 7.054 134
630.62 7.042 107
629.76 7.032 115
629.33 7.027 121
623.69 6.964 515
621.73 6.943 595
604.81 6.754 365
602.50 6.728 319
596.86 6.665 271
594.73 6.641 240
347.61 3.882 339