3-(2-Methylaminoethyl)indole(61-49-4) MS
Product Name3-(2-Methylaminoethyl)indole
CAS61-49-4
Molecular FormulaC11H14N2
Molecular Weight174.24
InChIInChI=1S/C11H14N2/c1-12-7-6-9-8-13-11-5-3-2-4-10(9)11/h2-5,8,12-13H,6-7H2,1H3
InChIKey NCIKQJBVUNUXLW-UHFFFAOYSA-N
SmilesN1C2=C(C=CC=C2)C(CCNC)=C1
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MassMS-NW-8073 2-(3-indolyl)-N-methylethylamine C11H14N2 (Mass of molecular ion: 174)
Source Temperature: 160 °C Sample Temperature: 100 °C Direct, 75 eV
18.0 2.2 28.0 1.7 39.0 1.0 42.0 2.0 44.0 91.5 45.0 2.4 51.0 1.8 63.0 1.4 76.0 1.2 77.0 8.0 78.0 1.0 89.0 1.4 102.0 2.7 103.0 6.6 115.0 2.4 117.0 1.7 128.0 2.0 129.0 1.8 130.0 57.1 131.0 100.0 132.0 10.7 143.0 2.0 144.0 1.9 174.0 10.4 175.0 2.1
400 MHz in CDCl3
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1H NMR 399.65 MHz C11 H14 N2 0.035 g : 0.5 ml CDCl3 2-(3-indolyl)-N-methylethylamine 
Assign. Shift(ppm)
A 8.82 B 7.626 C 7.311 D 7.181 E 7.109 F 6.961 G *1 2.985 J *1 2.927 K 2.436 L 1.38
Hz ppm Int.3526.37 8.824 35 3051.88 7.637 123 3044.07 7.617 131 2927.25 7.325 91 2926.39 7.323 133 2925.54 7.321 87 2919.19 7.305 123 2918.33 7.303 186 2917.48 7.301 113 2878.17 7.202 67 2877.08 7.200 71 2871.22 7.185 112 2870.00 7.182 136 2863.16 7.165 86 2861.94 7.162 79 2848.39 7.128 113 2847.29 7.125 112 2841.31 7.110 91 2840.45 7.108 155 2839.48 7.105 110 2833.50 7.090 70 2832.40 7.088 64 2781.98 6.962 177 1201.29 3.006 45 1199.71 3.002 51 1199.10 3.001 50 1193.24 2.986 201 1187.38 2.972 196 1175.66 2.942 164 1169.68 2.927 187 1166.99 2.921 71 1163.33 2.911 51 1161.13 2.906 44 973.63 2.437 1000
in CDCl3
KBr disc
nujol mull
