2,6-DIMETHYLPYRIDINIUM P-TOLUENESULFONATE(93471-41-1) 1H NMR
Product Name2,6-DIMETHYLPYRIDINIUM P-TOLUENESULFONATE
CAS93471-41-1
Molecular FormulaC14H17NO3S
Molecular Weight279.35
InChIInChI=1S/C7H9N.C7H8O3S/c1-6-4-3-5-7(2)8-6;1-6-2-4-7(5-3-6)11(8,9)10/h3-5H,1-2H3;2-5H,1H3,(H,8,9,10)
InChIKey ZXFCGHQVBSUJLX-UHFFFAOYSA-N
SmilesC1(S(O)(=O)=O)C=CC(C)=CC=1.N1C(C)=CC=CC=1C
400 MHz in DMSO-d6
-
1H NMR 399.65 MHz C7 H9 N 0.038 g : 0.5 ml DMSO-d6 2,6-dimethylpyridinium p-toluenesulfonate 
Assign. Shift(ppm)
A 8.346 B 7.717 C 7.510 D 7.128 E 2.678 F 2.287
Hz ppm Int.3343.87 8.367 62 3335.94 8.348 123 3328.00 8.328 70 3088.26 7.728 165 3080.32 7.708 156 3006.10 7.522 30 3004.27 7.518 175 3002.69 7.514 61 2997.92 7.502 66 2996.22 7.498 195 2994.38 7.493 33 2853.15 7.140 133 2852.54 7.138 153 2851.93 7.137 115 2850.59 7.133 48 2846.68 7.123 47 2845.34 7.120 107 2844.73 7.119 141 2844.12 7.117 124 1070.56 2.679 1000 914.18 2.288 488
D2O
in DMSO-d6
KBr disc
nujol mull
