Table 2. Spectral and Retention Data Experimentally Determined for O-Alkyl O-Trimethylsilyl Ethylphosphonates.
Lp. | R | molecular weightb | M+• in EI % | The base peak in EI m/z | [M + H]+ in CI m/z | [M + H]+ in CI % | [M + 29]+ in CI % | [M + 41]+ in CI % | m/z 167 in CI % | m/z 183 in CI % | [M + 73]+ in CI m/z | [M + 73]+ in CI % | base peak in CI m/z | LTPRI |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
1 | methyl | 196 | 7 | 181 | 197 | 100 | 23 | 10 | 2 | 2 | 269 | 1 | 197 | 1105 |
2 | ethyl | 210 | 7 | 167 | 211 | 100 | 27 | 13 | 5 | 6 | 283 | 18 | 211 | 1158 |
3 | 1-propyl | 224 | 167 | 225 | 100 | 26 | 15 | 12 | 21 | 297 | 24 | 225 | 1243 | |
4 | 1-butyl | 238 | 167 | 239 | 100 | 23 | 14 | 13 | 36 | 311 | 6 | 239 | 1334 | |
5 | 1-pentyl | 252 | 167 | 253 | 100 | 26 | 14 | 12 | 37 | 325 | 28 | 253 | 1425 | |
6 | 1-hexyl | 266 | 167 | 267 | 100 | 27 | 14 | 11 | 36 | 339 | 31 | 267 | 1522 | |
7 | 1-heptyl | 280 | 167 | 281 | 100 | 27 | 14 | 9 | 34 | 353 | 30 | 281 | 1617 | |
8 | 1-octyl | 294 | 167 | 295 | 100 | 27 | 13 | 8 | 32 | 367 | 24 | 295 | 1716 | |
9 | 1-nonyl | 308 | 167 | 309 | 100 | 26 | 12 | 7 | 30 | 381 | 12 | 309 | 1812 | |
10 | 1-decyl | 322 | 183 | 323 | 100 | 25 | 11 | 5 | 25 | 395 | 6 | 323 | 1914 | |
11 | 1-undecyl | 336 | 183 | 337 | 100 | 25 | 11 | 5 | 24 | 409 | 13 | 337 | 2010 | |
12 | 1-dodecyl | 350 | 183 | 351 | 100 | 24 | 10 | 5 | 23 | 423 | 7 | 351 | 2111 | |
13 | 2-propyl | 224 | 1 | 167 | 225 | 72 | 0 | 6 | 36 | 100 | 297 | 28 | 183 | 1180 |
14 | 2-butyla | 238 | 167 | 239 | 74 | 0 | 0 | 33 | 100 | 311 | 44 | 183 | 1272 | |
15 | 2-pentyla | 252 T | 167 | 253 | 60 | 6 | 3 | 31 | 100 | 325 | 30 | 183 | 1359 | |
16 | 2-hexyla | 266 T | 167 | 267 | 48 | 2 | 1 | 28 | 100 | 339 | 18 | 183 | 1430 | |
17 | cyclobutyl | 236 | 167 | 237 | 100 | 14 | 11 | 12 | 40 | 309 | 13 | 237 | 1368 | |
18 | cyclopentyl | 250 | 167 | 251 | 54 | 0 | 0 | 30 | 100 | 323 | 31 | 183 | 1465 | |
19 | cyclohexyl | 264 | 167 | 265 | 60 | 0 | 0 | 30 | 100 | 337 | 27 | 183 | 1564 | |
20 | cycloheptyl | 278 | 167 | 279 | 20 | 0 | 0 | 26 | 100 | 351 | 6 | 183 | 1690 | |
21 | cyclooctyl | 292 | 167 | 293 | 6 | 0 | 0 | 25 | 100 | 365 | 1 | 183 | 1807 | |
22 | 3-pentyl | 252 | 167 | 253 | 57 | 0 | 0 | 30 | 100 | 325 | 34 | 183 | 1364 | |
23 | 3-hexyla | 266 | 167 | 267 | 21 | 2 | 0 | 27 | 100 | 339 | 4 | 183 | 1430 | |
24 | 2-methyl-1-propyl | 238 | 167 | 239 | 97 | 12 | 15 | 36 | 100 | 311 | 8 | 183 | 1293 | |
25 | 2,2-dimethyl-1-propyl | 252 | 167 | 253 | 100 | 8 | 11 | 31 | 92 | 325 | 76 | 253 | 1328 | |
26 | 2-methyl-1-butyl | 252 | 167 | 253 | 93 | 10 | 13 | 35 | 100 | 325 | 24 | 183 | 1386 | |
27 | 3-methyl-1-butyla | 252 | 167 | 253 | 100 | 25 | 15 | 14 | 43 | 323 | 27 | 253 | 1387 | |
28 | 3-methyl-2-butyla | 252 T | 167 | 253 | 12 | 0 | 0 | 27 | 100 | 325 | 1 | 183 | 1340 | |
29 | 2-methyl-1-pentyla | 266 | 167 | 267 | 93 | 11 | 13 | 33 | 100 | 339 | 26 | 183 | 1469 | |
30 | 2-ethyl-1-butyl | 266 | 167 | 267 | 79 | 9 | 10 | 32 | 100 | 339 | 25 | 183 | 1471 | |
31 | 4-methyl-2-pentyla | 266 T | 167 | 267 | 18 | 1 | 1 | 27 | 100 | 339 | 2 | 183 | 1389 | |
32 | pinacolyla | 266 | 167 | 267 | 62 | 3 | 0 | 20 | 81 | 339 | 100 | 339 | 1387 |
Alcohol with a chiral center.
T – triple peaks in the chromatogram; LTPRI – linear temperature programmed retention index.