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Displaying retention index compounds 17601 - 17625 of 1722868 in total
RIpred ID Structure Name Chemical Structure Derivatization Type
Base compound Mass
GC Column/Stationary Phase Retention Index
3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid,2TBDMS,isomer#4JsmolC[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(C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3OTBDMS636.4605Semi standard non polar3849.5317
3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid,2TBDMS,isomer#5JsmolC[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(C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3OTBDMS636.4605Semi standard non polar3798.591
3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid,2TBDMS,isomer#6JsmolC[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(C)CC[C@@H](O)C[C@H]1C[C@H]3OTBDMS636.4605Semi standard non polar3838.8474
3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid,3TBDMS,isomer#1JsmolC[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(C)CC[C@@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)CTBDMS750.547Semi standard non polar3958.4512
3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid,3TBDMS,isomer#2JsmolC[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(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)CTBDMS750.547Semi standard non polar3941.7725
3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid,3TBDMS,isomer#3JsmolC[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(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)CTBDMS750.547Semi standard non polar3967.2468
3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid,3TBDMS,isomer#4JsmolC[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(C)CC[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3OTBDMS750.547Semi standard non polar3986.646
3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid,4TBDMS,isomer#1JsmolC[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(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)CTBDMS864.6335Semi standard non polar4162.0063
3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acidJsmol[H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@@H](O)[C@]12C)[C@H](C)CCC(O)=OUnderivatized408.2876Standard polar4216.655
3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acidJsmol[H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@@H](O)[C@]12C)[C@H](C)CCC(O)=OUnderivatized408.2876Standard non polar3464.1238
3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acidJsmol[H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@@H](O)[C@]12C)[C@H](C)CCC(O)=OUnderivatized408.2876Semi standard non polar3681.9438
16b-Hydroxyestrone,1TMS,isomer#1JsmolC[C@]12CC[C@@H]3C4=CC=C(O)C=C4CC[C@H]3[C@@H]1C[C@H](O[Si](C)(C)C)C2=OTMS358.1964Semi standard non polar2768.0334
16b-Hydroxyestrone,1TMS,isomer#2JsmolC[C@]12CC[C@@H]3C4=CC=C(O[Si](C)(C)C)C=C4CC[C@H]3[C@@H]1C[C@H](O)C2=OTMS358.1964Semi standard non polar2786.1277
16b-Hydroxyestrone,1TMS,isomer#3JsmolC[C@]12CC[C@@H]3C4=CC=C(O)C=C4CC[C@H]3[C@@H]1CC(O)=C2O[Si](C)(C)CTMS358.1964Semi standard non polar2768.1338
16b-Hydroxyestrone,2TMS,isomer#1JsmolC[C@]12CC[C@@H]3C4=CC=C(O[Si](C)(C)C)C=C4CC[C@H]3[C@@H]1C[C@H](O[Si](C)(C)C)C2=OTMS430.2359Semi standard non polar2875.1064
16b-Hydroxyestrone,2TMS,isomer#2JsmolC[C@]12CC[C@@H]3C4=CC=C(O)C=C4CC[C@H]3[C@@H]1CC(O[Si](C)(C)C)=C2O[Si](C)(C)CTMS430.2359Semi standard non polar2779.4495
16b-Hydroxyestrone,2TMS,isomer#3JsmolC[C@]12CC[C@@H]3C4=CC=C(O[Si](C)(C)C)C=C4CC[C@H]3[C@@H]1CC(O)=C2O[Si](C)(C)CTMS430.2359Semi standard non polar2838.9927
16b-Hydroxyestrone,1TBDMS,isomer#1JsmolCC(C)(C)[Si](C)(C)O[C@H]1C[C@H]2[C@@H]3CCC4=CC(O)=CC=C4[C@H]3CC[C@]2(C)C1=OTBDMS400.2434Semi standard non polar3049.548
16b-Hydroxyestrone,1TBDMS,isomer#2JsmolCC(C)(C)[Si](C)(C)OC1=CC=C2C(=C1)CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)[C@@H](O)C[C@@H]12TBDMS400.2434Semi standard non polar3088.4634
16b-Hydroxyestrone,1TBDMS,isomer#3JsmolCC(C)(C)[Si](C)(C)OC1=C(O)C[C@H]2[C@@H]3CCC4=CC(O)=CC=C4[C@H]3CC[C@]12CTBDMS400.2434Semi standard non polar3043.648
16b-Hydroxyestrone,2TBDMS,isomer#1JsmolCC(C)(C)[Si](C)(C)OC1=CC=C2C(=C1)CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)[C@@H](O[Si](C)(C)C(C)(C)C)C[C@@H]12TBDMS514.3298Semi standard non polar3412.7769
16b-Hydroxyestrone,2TBDMS,isomer#2JsmolCC(C)(C)[Si](C)(C)OC1=C(O[Si](C)(C)C(C)(C)C)[C@@]2(C)CC[C@@H]3C4=CC=C(O)C=C4CC[C@H]3[C@@H]2C1TBDMS514.3298Semi standard non polar3287.0981
16b-Hydroxyestrone,2TBDMS,isomer#3JsmolCC(C)(C)[Si](C)(C)OC1=C(O)C[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC=C4[C@H]3CC[C@]12CTBDMS514.3298Semi standard non polar3331.4954
16b-HydroxyestroneJsmol[H][C@@]12C[C@H](O)C(=O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3Underivatized286.1569Standard polar3438.5525
16b-Hydroxyestrone,3TMS,isomer#1JsmolC[C@]12CC[C@@H]3C4=CC=C(O[Si](C)(C)C)C=C4CC[C@H]3[C@@H]1CC(O[Si](C)(C)C)=C2O[Si](C)(C)CTMS502.2755Standard non polar2783.1177
Displaying retention index compounds 17601 - 17625 of 1722868 in total