N-HEXADECYLTRIMETHYLAMMONIUM HEXAFLUOROPHOSPHATE(101079-29-2) IR1
Product NameN-HEXADECYLTRIMETHYLAMMONIUM HEXAFLUOROPHOSPHATE
CAS101079-29-2
Molecular FormulaC19H42F6NP
Molecular Weight429.51
InChIInChI=1S/C19H42N.F6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;1-7(2,3,4,5)6/h5-19H2,1-4H3;/q+1;-1
InChIKey XIHYIALOMDSESV-UHFFFAOYSA-N
SmilesC(CC[N+](C)(C)C)CCCCCCCCCCCCC.[P-](F)(F)(F)(F)(F)F
400 MHz in DMSO-d6
-
1H NMR 399.65 MHz C19 H42 F6 N P 0.033 g : 0.5 ml DMSO-d6 hexadecyltrimethylammonium hexafluorophosphate 
Assign. Shift(ppm)
A 3.246 B 3.027 C 1.661 D 1.29 to 1.26 E 1.24 F 0.857
Hz ppm Int.1306.15 3.269 52 1301.27 3.257 30 1297.85 3.248 37 1297.49 3.247 37 1293.82 3.238 29 1289.06 3.226 54 1209.84 3.028 1000 671.39 1.680 22 671.02 1.680 22 667.24 1.670 25 663.21 1.660 29 660.64 1.654 23 659.91 1.652 23 659.55 1.651 23 655.76 1.641 22 509.77 1.276 130 496.70 1.243 994 349.37 0.875 63 342.77 0.858 223 335.69 0.840 75
in DMSO-d6
KBr disc
nujol mull
