2-HEXANOL(626-93-7) 13C NMR
Molecular FormulaC6H14O
Molecular Weight102.17
InChIInChI=1S/C6H14O/c1-3-4-5-6(2)7/h6-7H,3-5H2,1-2H3
InChIKey QNVRIHYSUZMSGM-UHFFFAOYSA-N
SmilesCC(O)CCCC
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MassMS-NW-1207 2-hexanol C6H14O (Mass of molecular ion: 102)
Source Temperature: 240 °C Sample Temperature: 180 °C Reservoir, 75 eV
15.0 1.1 19.0 1.1 27.0 6.4 28.0 1.5 29.0 5.1 31.0 2.0 39.0 3.2 41.0 12.0 42.0 3.4 43.0 7.0 44.0 6.9 45.0 100.0 46.0 2.3 55.0 3.9 56.0 3.6 57.0 2.4 58.0 1.3 69.0 14.5 84.0 4.1 87.0 5.3
90 MHz in CDCl3
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1H NMR 89.56 MHz C6 H14 O 0.04 ml : 0.5 ml CDCl3 2-hexanol 
Assign. Shift(ppm)
A 3.79 B 1.71 C 1.51 to 1.17 D 1.184 E 0.91
Hz ppm Int.342.63 3.826 31 336.56 3.758 36 153.44 1.714 84 132.69 1.482 51 131.63 1.470 56 130.94 1.463 51 128.81 1.439 105 127.69 1.426 121 123.25 1.377 259 121.44 1.356 165 121.06 1.352 167 120.88 1.350 167 119.44 1.334 138 117.81 1.316 137 113.19 1.264 64 112.19 1.253 54 111.44 1.245 51 109.00 1.218 1000 106.94 1.195 61 105.75 1.181 35 105.06 1.174 35 102.88 1.149 925 101.31 1.132 48 86.88 0.971 78 84.88 0.948 107 83.81 0.936 75 81.38 0.909 295 78.56 0.878 84 76.56 0.855 49 76.44 0.854 49 75.81 0.847 50 75.69 0.846 50 75.38 0.842 51 73.88 0.825 41
in CDCl3
CCl4 solution
liquid film
