Dicethiamine hydrochloride
Product Name Dicethiamine hydrochloride
CAS616-96-6
MFC18H26N4O6S.ClH
MW462.95
-
MassMS-IW-3781 Dicethiamine hydrochloride C18H26N4O6S HCl H2O (Mass of molecular ion: 426)
Source Temperature: 170 °C Sample Temperature: 140 °C Direct, 75 eV
28.0 1.0 29.0 3.8 36.0 1.6 39.0 2.0 42.0 6.2 44.0 1.1 54.0 2.5 80.0 2.5 81.0 8.3 110.0 1.1 122.0 100.0 123.0 9.7 125.0 3.2 200.0 1.4 321.0 18.0 322.0 3.3
400 MHz at 60C
400 MHz in CDCl3
-
1H NMR 399.65 MHz C18 H26 N4 O6 S 0.039 g : 0.5 ml CDCl3 at 60C dicethiamine hydrochloride 
Assign. Shift(ppm)
A 8.509 B 7.935 C 4.75 D 4.293 E *1 4.198 F *1 4.175 G 2.840 J 2.700 K 2.251 L *2 1.297 M *2 1.273 ASSIGNED BY C-H COSY. HSP-43-294
Hz ppm Int.3400.76 8.510 125 3171.39 7.936 414 1897.22 4.748 87 1722.41 4.310 112 1715.94 4.294 251 1709.59 4.278 120 1688.60 4.226 120 1681.52 4.208 377 1679.44 4.203 105 1677.98 4.199 34 1674.44 4.190 392 1672.36 4.185 295 1667.36 4.173 143 1665.16 4.167 295 1658.08 4.149 95 1141.72 2.857 54 1138.92 2.850 41 1135.13 2.841 100 1131.71 2.832 42 1128.66 2.825 55 1078.98 2.700 1000 899.66 2.252 705 525.39 1.315 398 521.24 1.305 30 518.31 1.297 820 515.99 1.292 350 511.23 1.280 405 508.79 1.274 701 505.62 1.266 46 501.71 1.256 327
-
1H NMR 399.65 MHz C18 H26 N4 O6 S 0.032 g : 0.5 ml CDCl3 dicethiamine hydrochloride Assign. Shift(ppm)
A 8.540 B 7.929 C 4.8 D 4.297 E *1 4.202 F *1 4.157 G 2.83 J 2.700 K 2.276 L *2 1.305 M *2 1.278 ASSIGNED BY H-H COSY AND ADDITION OF D2O. HSP-44-081 AT 60C
Hz ppm Int.3412.96 8.540 165 3168.95 7.930 525 1723.88 4.314 75 1717.53 4.298 159 1711.30 4.282 86 1690.55 4.231 124 1683.35 4.213 389 1676.27 4.195 399 1671.88 4.184 77 1669.19 4.177 143 1664.79 4.166 205 1657.59 4.148 204 1650.51 4.130 68 1130.86 2.830 31 1079.35 2.701 1000 909.67 2.277 730 905.03 2.265 56 528.56 1.323 445 521.48 1.305 939 518.07 1.297 379 514.40 1.288 459 510.86 1.279 755 503.78 1.261 350
in CDCl3
KBr disc
nujol mull
More Suppliers
