Product Name2-Phenylindole
CAS948-65-2
Molecular FormulaC14H11N
Molecular Weight193.24
InChIInChI=1S/C14H11N/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14/h1-10,15H
InChIKey KLLLJCACIRKBDT-UHFFFAOYSA-N
SmilesN1C2=C(C=CC=C2)C=C1C1=CC=CC=C1
Mass
MS-NW-4539 2-phenylindole C14H11N (Mass of molecular ion: 193)
Source Temperature: 240 °C Sample Temperature: 180 °C Reservoir, 75 eV
18.0 2.3 39.0 1.7 50.0 1.0 51.0 1.9 62.0 1.1 63.0 2.8 64.0 1.0 69.5 1.0 70.5 1.2 77.0 1.6 82.0 1.4 82.5 2.3 83.5 3.7 89.0 7.5 90.0 8.5 91.0 1.0 95.5 4.1 96.0 1.3 96.5 8.4 97.0 1.4 115.0 1.4 139.0 1.5 163.0 1.5 164.0 2.1 165.0 15.4 166.0 3.0 167.0 1.1 190.0 2.9 191.0 4.3 192.0 8.7 193.0 100.0 194.0 16.1 195.0 1.3
400 MHz in CDCl3
1H NMR | 399.65 MHz |
C14 H11 N | 16.4 mg : 0.5 ml CDCl3 |
2-phenylindole |
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Assign. Shift(ppm) |
Hz ppm Int.
3307.50 8.276 121 3067.14 7.675 33 3066.89 7.674 33 3066.53 7.674 33 3065.55 7.671 34 3065.19 7.670 34 3064.82 7.669 35 3064.09 7.667 35 3063.23 7.665 35 3061.77 7.662 40 3056.40 7.648 699 3055.05 7.645 885 3053.10 7.640 628 3048.83 7.629 536 3047.97 7.627 957 3046.75 7.624 919 3045.78 7.622 576 3045.04 7.620 562 3039.06 7.605 30 3036.87 7.599 30 3036.50 7.598 32 3035.89 7.597 33 3035.52 7.596 32 3035.16 7.595 33 2979.13 7.455 46 2978.52 7.453 46 2976.32 7.448 169 2975.34 7.445 421 2974.73 7.444 535 2972.90 7.439 237 2971.31 7.435 100 2967.41 7.426 1000 2966.19 7.422 506 2961.06 7.410 309 2959.47 7.406 615 2957.52 7.401 146 2956.05 7.397 86 2952.27 7.388 393 2951.42 7.386 377 2948.85 7.379 70 2948.49 7.378 67 2947.63 7.376 70 2947.27 7.375 69 2944.34 7.368 482 2943.36 7.365 464 2938.60 7.353 31 2930.42 7.333 236 2929.20 7.330 412 2927.98 7.327 234 2926.27 7.323 50 2925.29 7.320 50 2923.71 7.316 194 2921.88 7.312 502 2919.92 7.307 168 2917.60 7.301 42 2915.65 7.296 136 2914.43 7.293 220 2913.21 7.290 119 2885.25 7.220 31 2884.64 7.218 35 2881.96 7.212 282 2880.74 7.209 300 2877.44 7.200 43 2874.88 7.194 478 2873.78 7.191 510 2872.68 7.188 266 2870.00 7.182 45 2869.38 7.180 43 2866.94 7.174 402 2865.60 7.171 367 2863.53 7.166 36 2862.92 7.164 34 2862.06 7.162 32 2854.49 7.143 449 2853.39 7.140 446 2850.59 7.133 47 2849.61 7.131 45 2847.41 7.125 355 2846.68 7.123 512 2845.58 7.121 431 2843.26 7.115 45 2842.53 7.113 46 2841.31 7.110 39 2839.60 7.106 263 2838.50 7.103 239 2730.47 6.833 35 2727.05 6.824 545 2726.20 6.822 569 2724.98 6.819 589 2724.12 6.817 516
in CDCl3
KBr disc
nujol mull
2-Phenylindole(948-65-2) IR1 Atlas of Related Products
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