11-Bromo-1-undecanol(1611-56-9) 13C NMR
Product Name11-Bromo-1-undecanol
CAS1611-56-9
Molecular FormulaC11H23BrO
Molecular Weight251.2
InChIInChI=1S/C11H23BrO/c12-10-8-6-4-2-1-3-5-7-9-11-13/h13H,1-11H2
InChIKey XFGANBYCJWQYBI-UHFFFAOYSA-N
SmilesC(O)CCCCCCCCCCBr
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MassMS-IW-0764 11-bromo-1-undecanol C11H23BrO (Mass of molecular ion: 250)
Source Temperature: 180 °C Sample Temperature: 150 °C Reservoir, 75 eV
18.0 3.5 27.0 8.2 28.0 1.5 29.0 13.5 31.0 9.0 39.0 7.3 40.0 1.5 41.0 50.1 42.0 13.9 43.0 30.0 44.0 2.5 45.0 1.8 53.0 3.8 54.0 8.9 55.0 100.0 56.0 24.5 57.0 21.0 58.0 1.1 67.0 17.8 68.0 32.5 69.0 97.0 70.0 21.0 71.0 7.2 73.0 2.0 79.0 1.4 81.0 11.6 82.0 25.1 83.0 75.8 84.0 10.3 85.0 2.1 87.0 1.5 95.0 7.9 96.0 6.1 97.0 44.4 98.0 5.5 107.0 2.0 109.0 4.2 110.0 2.4 111.0 10.9 112.0 1.1 121.0 1.3 123.0 3.9 124.0 2.1 125.0 6.8 134.0 2.8 135.0 10.7 136.0 3.0 137.0 10.0 148.0 27.9 149.0 4.5 150.0 27.1 151.0 4.0 162.0 20.3 163.0 2.7 164.0 19.5 165.0 2.1 176.0 2.0 178.0 1.8 190.0 1.2 192.0 1.0 204.0 3.7 206.0 3.5
400 MHz in CDCl3
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1H NMR 399.65 MHz C11 H23 Br O 0.042 g : 0.5 ml CDCl3 11-bromo-1-undecanol 
Assign. Shift(ppm)
A 3.629 B 3.407 C 1.850 D 1.63 E 1.56 F 1.42 G 1.34 J 1.32 K 1.28
Hz ppm Int.1457.15 3.647 150 1450.56 3.630 291 1443.85 3.613 155 1368.77 3.425 307 1361.94 3.408 624 1355.10 3.391 326 754.27 1.888 70 747.31 1.870 183 740.23 1.853 198 732.54 1.833 191 725.71 1.816 81 653.32 1.635 164 637.70 1.596 33 630.98 1.579 96 623.66 1.561 137 616.46 1.543 127 609.74 1.526 51 574.95 1.439 78 572.27 1.432 67 567.87 1.421 108 560.55 1.403 88 553.47 1.385 51 550.78 1.379 36 538.82 1.349 110 534.06 1.337 135 533.08 1.334 133 525.39 1.315 257 524.41 1.313 258 512.82 1.284 1000
in CDCl3
KBr disc
nujol mull
