RI00022276 | 7-Hydroxy-3-oxocholanoic acid,1TMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)C1CC[C@H]2[C@@H]3[C@@H](O)C[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C | TMS | 462.3165 | Semi standard non polar | 3384.021 |
RI00022277 | 7-Hydroxy-3-oxocholanoic acid,1TMS,isomer#2 | JsmolC[C@H](CCC(=O)O)C1CC[C@H]2[C@@H]3[C@@H](O[Si](C)(C)C)C[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C | TMS | 462.3165 | Semi standard non polar | 3365.3398 |
RI00022278 | 7-Hydroxy-3-oxocholanoic acid,1TMS,isomer#3 | JsmolC[C@H](CCC(=O)O)C1CC[C@H]2[C@@H]3[C@@H](O)C[C@H]4CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3CC[C@]12C | TMS | 462.3165 | Semi standard non polar | 3402.2622 |
RI00022279 | 7-Hydroxy-3-oxocholanoic acid,1TMS,isomer#4 | JsmolC[C@H](CCC(=O)O)C1CC[C@H]2[C@@H]3[C@@H](O)C[C@H]4C=C(O[Si](C)(C)C)CC[C@]4(C)[C@H]3CC[C@]12C | TMS | 462.3165 | Semi standard non polar | 3371.059 |
RI00022280 | 7-Hydroxy-3-oxocholanoic acid,2TMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)C1CC[C@H]2[C@@H]3[C@@H](O[Si](C)(C)C)C[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C | TMS | 534.3561 | Semi standard non polar | 3278.3413 |
RI00022281 | 7-Hydroxy-3-oxocholanoic acid,2TMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)C1CC[C@H]2[C@@H]3[C@@H](O)C[C@H]4CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3CC[C@]12C | TMS | 534.3561 | Semi standard non polar | 3345.294 |
RI00022282 | 7-Hydroxy-3-oxocholanoic acid,2TMS,isomer#3 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)C1CC[C@H]2[C@@H]3[C@@H](O)C[C@H]4C=C(O[Si](C)(C)C)CC[C@]4(C)[C@H]3CC[C@]12C | TMS | 534.3561 | Semi standard non polar | 3322.0706 |
RI00022283 | 7-Hydroxy-3-oxocholanoic acid,2TMS,isomer#4 | JsmolC[C@H](CCC(=O)O)C1CC[C@H]2[C@@H]3[C@@H](O[Si](C)(C)C)C[C@H]4CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3CC[C@]12C | TMS | 534.3561 | Semi standard non polar | 3318.333 |
RI00022284 | 7-Hydroxy-3-oxocholanoic acid,2TMS,isomer#5 | JsmolC[C@H](CCC(=O)O)C1CC[C@H]2[C@@H]3[C@@H](O[Si](C)(C)C)C[C@H]4C=C(O[Si](C)(C)C)CC[C@]4(C)[C@H]3CC[C@]12C | TMS | 534.3561 | Semi standard non polar | 3283.9077 |
RI00022285 | 7-Hydroxy-3-oxocholanoic acid,1TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3[C@@H](O)C[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 504.3635 | Semi standard non polar | 3647.8186 |
RI00022286 | 7-Hydroxy-3-oxocholanoic acid,1TBDMS,isomer#2 | JsmolC[C@H](CCC(=O)O)C1CC[C@H]2[C@@H]3[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 504.3635 | Semi standard non polar | 3588.631 |
RI00022287 | 7-Hydroxy-3-oxocholanoic acid,1TBDMS,isomer#3 | JsmolC[C@H](CCC(=O)O)C1CC[C@H]2[C@@H]3[C@@H](O)C[C@H]4CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 504.3635 | Semi standard non polar | 3650.7056 |
RI00022288 | 7-Hydroxy-3-oxocholanoic acid,1TBDMS,isomer#4 | JsmolC[C@H](CCC(=O)O)C1CC[C@H]2[C@@H]3[C@@H](O)C[C@H]4C=C(O[Si](C)(C)C(C)(C)C)CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 504.3635 | Semi standard non polar | 3595.125 |
RI00022289 | 7-Hydroxy-3-oxocholanoic acid,2TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 618.45 | Semi standard non polar | 3762.5356 |
RI00022290 | 7-Hydroxy-3-oxocholanoic acid,2TBDMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3[C@@H](O)C[C@H]4CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 618.45 | Semi standard non polar | 3820.6392 |
RI00022291 | 7-Hydroxy-3-oxocholanoic acid,2TBDMS,isomer#3 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3[C@@H](O)C[C@H]4C=C(O[Si](C)(C)C(C)(C)C)CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 618.45 | Semi standard non polar | 3779.8071 |
RI00022292 | 7-Hydroxy-3-oxocholanoic acid,2TBDMS,isomer#4 | JsmolC[C@H](CCC(=O)O)C1CC[C@H]2[C@@H]3[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]4CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 618.45 | Semi standard non polar | 3742.2725 |
RI00022293 | 7-Hydroxy-3-oxocholanoic acid,2TBDMS,isomer#5 | JsmolC[C@H](CCC(=O)O)C1CC[C@H]2[C@@H]3[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]4C=C(O[Si](C)(C)C(C)(C)C)CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 618.45 | Semi standard non polar | 3688.231 |
RI00022294 | 7-Hydroxy-3-oxocholanoic acid | Jsmol[H][C@@]12CCC([C@H](C)CCC(O)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])[C@@H](O)C[C@@]2([H])CC(=O)CC[C@]12C | Underivatized | 390.277 | Standard polar | 3683.8118 |
RI00022295 | 7-Hydroxy-3-oxocholanoic acid,3TMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)C1CC[C@H]2[C@@H]3[C@@H](O[Si](C)(C)C)C[C@H]4CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3CC[C@]12C | TMS | 606.3956 | Standard non polar | 3324.7854 |
RI00022296 | 7-Hydroxy-3-oxocholanoic acid,3TMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C)C1CC[C@H]2[C@@H]3[C@@H](O[Si](C)(C)C)C[C@H]4C=C(O[Si](C)(C)C)CC[C@]4(C)[C@H]3CC[C@]12C | TMS | 606.3956 | Standard non polar | 3337.9458 |
RI00022297 | 7-Hydroxy-3-oxocholanoic acid,3TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]4CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 732.5364 | Standard non polar | 3828.6895 |
RI00022298 | 7-Hydroxy-3-oxocholanoic acid,3TBDMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]4C=C(O[Si](C)(C)C(C)(C)C)CC[C@]4(C)[C@H]3CC[C@]12C | TBDMS | 732.5364 | Standard non polar | 3901.6362 |
RI00022299 | 7-Hydroxy-3-oxocholanoic acid | Jsmol[H][C@@]12CCC([C@H](C)CCC(O)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])[C@@H](O)C[C@@]2([H])CC(=O)CC[C@]12C | Underivatized | 390.277 | Standard non polar | 3318.691 |
RI00022300 | 7-Hydroxy-3-oxocholanoic acid | Jsmol[H][C@@]12CCC([C@H](C)CCC(O)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])[C@@H](O)C[C@@]2([H])CC(=O)CC[C@]12C | Underivatized | 390.277 | Semi standard non polar | 3484.8513 |