RI00018501 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,3TBDMS,isomer#4 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(CO[Si](C)(C)C(C)(C)C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O | TBDMS | 766.5419 | Semi standard non polar | 4136.351 |
RI00018502 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,3TBDMS,isomer#5 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(CO[Si](C)(C)C(C)(C)C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 766.5419 | Semi standard non polar | 4071.9849 |
RI00018503 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,3TBDMS,isomer#6 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(CO)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 766.5419 | Semi standard non polar | 4077.834 |
RI00018504 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,3TBDMS,isomer#7 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C)[C@@]1(CO[Si](C)(C)C(C)(C)C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O | TBDMS | 766.5419 | Semi standard non polar | 4120.4277 |
RI00018505 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,3TBDMS,isomer#8 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C)[C@@]1(CO[Si](C)(C)C(C)(C)C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 766.5419 | Semi standard non polar | 4096.902 |
RI00018506 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,3TBDMS,isomer#9 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C)[C@@]1(CO)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 766.5419 | Semi standard non polar | 4090.1616 |
RI00018507 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,3TBDMS,isomer#10 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(CO[Si](C)(C)C(C)(C)C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 766.5419 | Semi standard non polar | 4102.057 |
RI00018508 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,4TBDMS,isomer#1 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C)[C@@]1(CO[Si](C)(C)C(C)(C)C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O | TBDMS | 880.6284 | Semi standard non polar | 4322.395 |
RI00018509 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,4TBDMS,isomer#2 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C)[C@@]1(CO[Si](C)(C)C(C)(C)C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 880.6284 | Semi standard non polar | 4294.535 |
RI00018510 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,4TBDMS,isomer#3 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C)[C@@]1(CO)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 880.6284 | Semi standard non polar | 4263.983 |
RI00018511 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,4TBDMS,isomer#4 | JsmolC[C@H](CCC(=O)O[Si](C)(C)C(C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(CO[Si](C)(C)C(C)(C)C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 880.6284 | Semi standard non polar | 4298.4414 |
RI00018512 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,4TBDMS,isomer#5 | JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O[Si](C)(C)C(C)(C)C)[C@@]21C)[C@@]1(CO[Si](C)(C)C(C)(C)C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)C | TBDMS | 880.6284 | Semi standard non polar | 4306.8853 |
RI00018513 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid | Jsmol[H][C@@]12CC[C@H]([C@H](C)CCC(O)=O)[C@@]1(C)[C@@H](O)C[C@@]1([H])[C@@]2([H])[C@H](O)C[C@]2([H])C[C@H](O)CC[C@]12CO | Underivatized | 424.2825 | Standard polar | 4330.866 |
RI00018514 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid | Jsmol[H][C@@]12CC[C@H]([C@H](C)CCC(O)=O)[C@@]1(C)[C@@H](O)C[C@@]1([H])[C@@]2([H])[C@H](O)C[C@]2([H])C[C@H](O)CC[C@]12CO | Underivatized | 424.2825 | Standard non polar | 3636.7085 |
RI00018515 | 3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid | Jsmol[H][C@@]12CC[C@H]([C@H](C)CCC(O)=O)[C@@]1(C)[C@@H](O)C[C@@]1([H])[C@@]2([H])[C@H](O)C[C@]2([H])C[C@H](O)CC[C@]12CO | Underivatized | 424.2825 | Semi standard non polar | 3964.6187 |
RI00018516 | 2-Octenedioic acid,1TMS,isomer#1 | JsmolC[Si](C)(C)OC(=O)CCCC/C=C/C(=O)O | TMS | 244.1131 | Semi standard non polar | 1662.7766 |
RI00018517 | 2-Octenedioic acid,1TMS,isomer#2 | JsmolC[Si](C)(C)OC(=O)/C=C/CCCCC(=O)O | TMS | 244.1131 | Semi standard non polar | 1661.7609 |
RI00018518 | 2-Octenedioic acid,2TMS,isomer#1 | JsmolC[Si](C)(C)OC(=O)/C=C/CCCCC(=O)O[Si](C)(C)C | TMS | 316.1526 | Semi standard non polar | 1733.5851 |
RI00018519 | 2-Octenedioic acid,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=O)CCCC/C=C/C(=O)O | TBDMS | 286.16 | Semi standard non polar | 1911.3542 |
RI00018520 | 2-Octenedioic acid,1TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)OC(=O)/C=C/CCCCC(=O)O | TBDMS | 286.16 | Semi standard non polar | 1903.0735 |
RI00018521 | 2-Octenedioic acid,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=O)/C=C/CCCCC(=O)O[Si](C)(C)C(C)(C)C | TBDMS | 400.2465 | Semi standard non polar | 2176.9402 |
RI00018522 | 2-Octenedioic acid | JsmolOC(=O)CCCC\C=C\C(O)=O | Underivatized | 172.0736 | Standard polar | 2713.788 |
RI00018523 | 2-Octenedioic acid | JsmolOC(=O)CCCC\C=C\C(O)=O | Underivatized | 172.0736 | Standard non polar | 1357.651 |
RI00018524 | 2-Octenedioic acid | JsmolOC(=O)CCCC\C=C\C(O)=O | Underivatized | 172.0736 | Semi standard non polar | 1593.4543 |
RI00018525 | 2-Hydroxyestrone,1TMS,isomer#1 | JsmolC[C@]12CC[C@@H]3C4=CC(O)=C(O[Si](C)(C)C)C=C4CC[C@H]3[C@@H]1CCC2=O | TMS | 358.1964 | Semi standard non polar | 2831.9944 |