2-(Butylamino)ethanol (111-75-1) Raman
Product Name2-(Butylamino)ethanol
CAS111-75-1
Molecular FormulaC6H15NO
Molecular Weight117.19
InChIInChI=1S/C6H15NO/c1-2-3-4-7-5-6-8/h7-8H,2-6H2,1H3
InChIKey LJDSTRZHPWMDPG-UHFFFAOYSA-N
SmilesC(O)CNCCCC
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MassMS-NW-2114 2-(butylamino)ethanol C6H15NO (Mass of molecular ion: 117)
Source Temperature: 250 °C Sample Temperature: 170 °C Reservoir, 75 eV
15.0 4.4 17.0 1.3 18.0 6.8 19.0 1.0 26.0 1.5 27.0 13.3 28.0 13.9 29.0 31.1 30.0 89.4 31.0 3.2 39.0 5.8 40.0 1.1 41.0 25.0 42.0 17.6 43.0 10.6 44.0 61.0 45.0 9.4 53.0 1.1 54.0 1.5 55.0 5.1 56.0 48.1 57.0 26.3 58.0 1.9 60.0 3.7 70.0 2.2 71.0 1.2 72.0 2.0 74.0 73.6 75.0 2.9 84.0 3.8 86.0 100.0 87.0 6.1 98.0 2.7 99.0 2.0 116.0 2.1 117.0 7.4 128.0 2.1
90 MHz in CDCl3
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1H NMR 89.56 MHz C6 H15 N O 0.04 ml : 0.5 ml CDCl3 2-(butylamino)ethanol 
Assign. Shift(ppm)
A 3.65 B 2.99 C 2.74 D 2.62 E 1.48 F 1.35 G 0.93
Hz ppm Int.332.19 3.710 399 328.94 3.673 132 327.13 3.653 503 325.88 3.639 289 324.56 3.624 135 321.75 3.593 535 267.69 2.989 1000 250.63 2.799 538 247.81 2.767 151 246.50 2.753 297 245.31 2.740 519 243.38 2.718 161 240.31 2.684 483 234.56 2.620 373 230.44 2.574 70 227.63 2.542 262 143.06 1.598 37 141.13 1.576 77 138.81 1.550 108 137.63 1.537 57 135.69 1.516 133 134.81 1.506 142 132.75 1.483 254 131.31 1.467 176 129.44 1.446 298 128.25 1.433 297 126.50 1.413 246 125.31 1.400 329 123.25 1.377 207 122.19 1.365 224 119.25 1.332 126 118.44 1.323 119 117.13 1.308 109 116.56 1.302 101 115.81 1.294 115 113.75 1.271 64 110.38 1.233 82 109.81 1.227 85 108.00 1.206 47 104.00 1.162 40 102.81 1.148 46 89.75 1.003 222 88.88 0.993 343 82.50 0.922 755 80.00 0.894 196 78.50 0.877 153 76.50 0.855 111 75.06 0.839 140 73.00 0.816 70
in CDCl3
CCl4 solution
liquid film
4880 A,200 M,liquid
