Tetrabutylammonium Fluoride(429-41-4) MS
Product NameTetrabutylammonium Fluoride
CAS429-41-4
Molecular FormulaC16H36FN
Molecular Weight261.46
InChIInChI=1S/C16H36N.FH/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;/h5-16H2,1-4H3;1H/q+1;/p-1
InChIKey FPGGTKZVZWFYPV-UHFFFAOYSA-M
Smiles[N+](CCCC)(CCCC)(CCCC)CCCC.[F-]
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MassMS-NW-9998 tetrabutylammonium fluoride C16H36FN 3H2O (Mass of molecular ion: 261)
Source Temperature: 150 °C Sample Temperature: 80 °C Direct, 75 eV
17.0 1.6 18.0 8.6 27.0 4.1 28.0 4.9 29.0 9.2 30.0 4.0 39.0 5.8 40.0 1.2 41.0 26.0 42.0 4.3 43.0 2.0 44.0 5.5 53.0 1.4 55.0 7.0 56.0 11.8 57.0 5.4 58.0 3.4 84.0 1.8 86.0 2.5 98.0 2.5 100.0 23.5 101.0 1.6 142.0 100.0 143.0 10.2 184.0 1.0 185.0 8.8 186.0 1.2
400 MHz in CDCl3
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1H NMR 399.65 MHz C16 H36 F N 0.041 g : 0.5 ml CDCl3 tetrabutylammonium fluoride 
Assign. Shift(ppm)
A 3.314 B 1.662 C 1.451 D 1.003
Hz ppm Int.1332.64 3.335 218 1327.03 3.321 141 1324.10 3.314 176 1315.55 3.292 226 680.79 1.704 52 673.46 1.686 115 668.46 1.673 115 664.79 1.664 166 660.77 1.654 116 656.98 1.644 141 648.93 1.624 71 598.39 1.498 42 591.06 1.479 155 583.62 1.461 262 576.17 1.442 257 568.85 1.424 146 561.52 1.406 39 409.79 1.026 540 402.59 1.008 1000 395.14 0.989 465
in CDCl3
KBr disc
nujol mull
