5-甲基-1,10-菲咯啉(3002-78-6)核磁圖(1HNMR)
InChI:InChI=1S/C13H10N2/c1-9-8-10-4-2-6-14-12(10)13-11(9)5-3-7-15-13/h2-8H,1H3
InChIKey: UJAQYOZROIFQHO-UHFFFAOYSA-N
Smiles:N1C2C(=C(C)C=C3C=2N=CC=C3)C=CC=1
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Mass
MS-NW-7801
5-methyl-1,10-phenanthroline
C13H10N2 (Mass of molecular ion: 194)
Source Temperature: 160 °C
Sample Temperature: 130 °C
Direct, 75 eV
39.0 2.2
50.0 1.4
51.0 1.9
62.0 1.2
63.0 3.0
69.5 2.0
70.5 1.8
74.0 1.0
75.0 1.4
76.0 1.1
82.5 2.5
83.0 1.8
83.5 2.5
84.0 2.7
87.0 1.1
88.0 1.0
89.0 1.1
96.0 1.4
96.5 1.6
97.0 3.0
113.0 1.3
114.0 1.4
138.0 1.2
139.0 3.9
140.0 4.5
141.0 1.3
164.0 2.4
165.0 2.0
166.0 6.3
167.0 5.7
168.0 3.2
191.0 1.1
192.0 8.9
193.0 26.2
194.0 100.0
195.0 14.9
196.0 1.1
90 MHz in CDCl3
400 MHz in CDCl3
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| 1H NMR |
89.56 MHz |
| C13 H10 N2
|
0.040 g : 0.5 ml CDCl3
|
| 5-methyl-1,10-phenanthroline
|
 |
Assign. Shift(ppm)
A 9.15
B 9.10
C 8.30
D 8.07
E 7.61
F 7.54
G 7.50
J 2.66
|
Hz ppm Int.
823.38 9.194 160
821.63 9.175 173
819.06 9.146 176
817.38 9.127 313
815.69 9.108 161
813.06 9.079 155
811.31 9.059 157
748.88 8.362 162
747.19 8.343 163
740.56 8.269 212
738.88 8.251 210
727.88 8.128 128
726.13 8.108 129
719.75 8.037 177
718.06 8.018 172
686.94 7.671 297
682.63 7.623 283
680.69 7.601 272
678.63 7.578 239
676.31 7.552 255
674.31 7.530 234
672.56 7.510 282
671.81 7.502 237
670.75 7.490 235
668.25 7.462 201
239.06 2.670 973
237.94 2.657 1000
235.06 2.625 44
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| 1H NMR |
399.65 MHz |
| C13 H10 N2
|
7.7 mg : 0.5 ml CDCl3
|
| 5-methyl-1,10-phenanthroline
|
|
Assign. Shift(ppm)
A 9.202
B 9.130
C 8.393
D 8.150
E 7.671
F 7.60
G 7.597
J 2.753
J(A,E)=4.3HZ. J(A,C)=1.6HZ. J(B,G)=4.4HZ.
J(B,D)=1.8HZ. J(F,J)=1.2HZ.
|
Hz ppm Int.
3680.54 9.210 133
3678.96 9.206 137
3676.27 9.199 141
3674.68 9.195 138
3651.86 9.138 121
3650.02 9.134 129
3647.46 9.127 129
3645.75 9.123 126
3359.62 8.407 168
3357.91 8.403 169
3351.32 8.386 185
3349.61 8.382 183
3262.33 8.163 140
3260.62 8.159 142
3254.27 8.143 152
3252.56 8.139 151
3072.14 7.688 221
3067.87 7.677 221
3063.84 7.667 212
3059.57 7.656 210
3041.75 7.612 217
3037.35 7.601 404
3033.69 7.591 203
3029.42 7.581 194
1100.95 2.755 1000
1099.85 2.753 961
1095.83 2.742 35