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Displaying retention index compounds 18501 - 18525 of 1722868 in total
RIpred ID Structure Name Chemical Structure Derivatization Type
Base compound Mass
GC Column/Stationary Phase Retention Index
3a,7a,12a,19-Tetrahydroxy-5b-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)[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]3OTBDMS766.5419Semi standard non polar4136.351
3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,3TBDMS,isomer#5JsmolC[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)CTBDMS766.5419Semi standard non polar4071.9849
3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,3TBDMS,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)[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)CTBDMS766.5419Semi standard non polar4077.834
3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,3TBDMS,isomer#7JsmolC[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]3OTBDMS766.5419Semi standard non polar4120.4277
3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,3TBDMS,isomer#8JsmolC[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)CTBDMS766.5419Semi standard non polar4096.902
3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,3TBDMS,isomer#9JsmolC[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)CTBDMS766.5419Semi standard non polar4090.1616
3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,3TBDMS,isomer#10JsmolC[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)CTBDMS766.5419Semi standard non polar4102.057
3a,7a,12a,19-Tetrahydroxy-5b-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(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]3OTBDMS880.6284Semi standard non polar4322.395
3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,4TBDMS,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[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)CTBDMS880.6284Semi standard non polar4294.535
3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,4TBDMS,isomer#3JsmolC[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)CTBDMS880.6284Semi standard non polar4263.983
3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,4TBDMS,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(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)CTBDMS880.6284Semi standard non polar4298.4414
3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acid,4TBDMS,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(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)CTBDMS880.6284Semi standard non polar4306.8853
3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acidJsmol[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@]12COUnderivatized424.2825Standard polar4330.866
3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acidJsmol[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@]12COUnderivatized424.2825Standard non polar3636.7085
3a,7a,12a,19-Tetrahydroxy-5b-cholanoic acidJsmol[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@]12COUnderivatized424.2825Semi standard non polar3964.6187
2-Octenedioic acid,1TMS,isomer#1JsmolC[Si](C)(C)OC(=O)CCCC/C=C/C(=O)OTMS244.1131Semi standard non polar1662.7766
2-Octenedioic acid,1TMS,isomer#2JsmolC[Si](C)(C)OC(=O)/C=C/CCCCC(=O)OTMS244.1131Semi standard non polar1661.7609
2-Octenedioic acid,2TMS,isomer#1JsmolC[Si](C)(C)OC(=O)/C=C/CCCCC(=O)O[Si](C)(C)CTMS316.1526Semi standard non polar1733.5851
2-Octenedioic acid,1TBDMS,isomer#1JsmolCC(C)(C)[Si](C)(C)OC(=O)CCCC/C=C/C(=O)OTBDMS286.16Semi standard non polar1911.3542
2-Octenedioic acid,1TBDMS,isomer#2JsmolCC(C)(C)[Si](C)(C)OC(=O)/C=C/CCCCC(=O)OTBDMS286.16Semi standard non polar1903.0735
2-Octenedioic acid,2TBDMS,isomer#1JsmolCC(C)(C)[Si](C)(C)OC(=O)/C=C/CCCCC(=O)O[Si](C)(C)C(C)(C)CTBDMS400.2465Semi standard non polar2176.9402
2-Octenedioic acidJsmolOC(=O)CCCC\C=C\C(O)=OUnderivatized172.0736Standard polar2713.788
2-Octenedioic acidJsmolOC(=O)CCCC\C=C\C(O)=OUnderivatized172.0736Standard non polar1357.651
2-Octenedioic acidJsmolOC(=O)CCCC\C=C\C(O)=OUnderivatized172.0736Semi standard non polar1593.4543
2-Hydroxyestrone,1TMS,isomer#1JsmolC[C@]12CC[C@@H]3C4=CC(O)=C(O[Si](C)(C)C)C=C4CC[C@H]3[C@@H]1CCC2=OTMS358.1964Semi standard non polar2831.9944
Displaying retention index compounds 18501 - 18525 of 1722868 in total