RIpred (Beta) is still undergoing development. Please feel free to explore and use the predictor. Please provide us with your feedback..

Displaying retention index compounds 18801 - 18825 of 1722868 in total
RIpred ID Structure Name Chemical Structure Derivatization Type
Base compound Mass
GC Column/Stationary Phase Retention Index
2,4-Dihydroxybutanoic acid,2TMS,isomer#3JsmolC[Si](C)(C)OC(=O)C(CCO)O[Si](C)(C)CTMS264.1213Semi standard non polar1327.8335
2,4-Dihydroxybutanoic acid,3TMS,isomer#1JsmolC[Si](C)(C)OCCC(O[Si](C)(C)C)C(=O)O[Si](C)(C)CTMS336.1608Semi standard non polar1427.5377
2,4-Dihydroxybutanoic acid,1TBDMS,isomer#1JsmolCC(C)(C)[Si](C)(C)OCCC(O)C(=O)OTBDMS234.1287Semi standard non polar1506.5225
2,4-Dihydroxybutanoic acid,1TBDMS,isomer#2JsmolCC(C)(C)[Si](C)(C)OC(CCO)C(=O)OTBDMS234.1287Semi standard non polar1520.9589
2,4-Dihydroxybutanoic acid,1TBDMS,isomer#3JsmolCC(C)(C)[Si](C)(C)OC(=O)C(O)CCOTBDMS234.1287Semi standard non polar1451.8699
2,4-Dihydroxybutanoic acid,2TBDMS,isomer#1JsmolCC(C)(C)[Si](C)(C)OCCC(O[Si](C)(C)C(C)(C)C)C(=O)OTBDMS348.2152Semi standard non polar1813.1426
2,4-Dihydroxybutanoic acid,2TBDMS,isomer#2JsmolCC(C)(C)[Si](C)(C)OCCC(O)C(=O)O[Si](C)(C)C(C)(C)CTBDMS348.2152Semi standard non polar1757.6555
2,4-Dihydroxybutanoic acid,2TBDMS,isomer#3JsmolCC(C)(C)[Si](C)(C)OC(=O)C(CCO)O[Si](C)(C)C(C)(C)CTBDMS348.2152Semi standard non polar1764.0558
2,4-Dihydroxybutanoic acid,3TBDMS,isomer#1JsmolCC(C)(C)[Si](C)(C)OCCC(O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)CTBDMS462.3017Semi standard non polar2041.6013
2,4-Dihydroxybutanoic acidJsmolOCCC(O)C(O)=OUnderivatized120.0423Standard polar2423.982
2,4-Dihydroxybutanoic acidJsmolOCCC(O)C(O)=OUnderivatized120.0423Standard non polar1111.9009
2,4-Dihydroxybutanoic acidJsmolOCCC(O)C(O)=OUnderivatized120.0423Semi standard non polar1217.6782
3b,7a-Dihydroxy-5b-cholanoic acid,1TMS,isomer#1JsmolC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@@]21C)[C@@]1(C)CC[C@H](O)C[C@H]1C[C@H]3OTMS464.3322Semi standard non polar3313.4497
3b,7a-Dihydroxy-5b-cholanoic acid,1TMS,isomer#2JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@@]21C)[C@@]1(C)CC[C@H](O)C[C@H]1C[C@H]3O[Si](C)(C)CTMS464.3322Semi standard non polar3313.3862
3b,7a-Dihydroxy-5b-cholanoic acid,1TMS,isomer#3JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@@]21C)[C@@]1(C)CC[C@H](O[Si](C)(C)C)C[C@H]1C[C@H]3OTMS464.3322Semi standard non polar3372.309
3b,7a-Dihydroxy-5b-cholanoic acid,2TMS,isomer#1JsmolC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@@]21C)[C@@]1(C)CC[C@H](O[Si](C)(C)C)C[C@H]1C[C@H]3OTMS536.3717Semi standard non polar3321.5166
3b,7a-Dihydroxy-5b-cholanoic acid,2TMS,isomer#2JsmolC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@@]21C)[C@@]1(C)CC[C@H](O)C[C@H]1C[C@H]3O[Si](C)(C)CTMS536.3717Semi standard non polar3232.5874
3b,7a-Dihydroxy-5b-cholanoic acid,2TMS,isomer#3JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@@]21C)[C@@]1(C)CC[C@H](O[Si](C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)CTMS536.3717Semi standard non polar3259.3975
3b,7a-Dihydroxy-5b-cholanoic acid,3TMS,isomer#1JsmolC[C@H](CCC(=O)O[Si](C)(C)C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@@]21C)[C@@]1(C)CC[C@H](O[Si](C)(C)C)C[C@H]1C[C@H]3O[Si](C)(C)CTMS608.4112Semi standard non polar3235.5168
3b,7a-Dihydroxy-5b-cholanoic acid,1TBDMS,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](CC[C@@]21C)[C@@]1(C)CC[C@H](O)C[C@H]1C[C@H]3OTBDMS506.3791Semi standard non polar3577.276
3b,7a-Dihydroxy-5b-cholanoic acid,1TBDMS,isomer#2JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@@]21C)[C@@]1(C)CC[C@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)CTBDMS506.3791Semi standard non polar3530.114
3b,7a-Dihydroxy-5b-cholanoic acid,1TBDMS,isomer#3JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@@]21C)[C@@]1(C)CC[C@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3OTBDMS506.3791Semi standard non polar3592.038
3b,7a-Dihydroxy-5b-cholanoic acid,2TBDMS,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](CC[C@@]21C)[C@@]1(C)CC[C@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C[C@H]3OTBDMS620.4656Semi standard non polar3813.8745
3b,7a-Dihydroxy-5b-cholanoic acid,2TBDMS,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](CC[C@@]21C)[C@@]1(C)CC[C@H](O)C[C@H]1C[C@H]3O[Si](C)(C)C(C)(C)CTBDMS620.4656Semi standard non polar3702.5898
3b,7a-Dihydroxy-5b-cholanoic acid,2TBDMS,isomer#3JsmolC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](CC[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)CTBDMS620.4656Semi standard non polar3698.715
Displaying retention index compounds 18801 - 18825 of 1722868 in total