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Displaying retention index compounds 22276 - 22300 of 1722868 in total
RIpred ID Structure Name Chemical Structure Derivatization Type
Base compound Mass
GC Column/Stationary Phase Retention Index
7-Hydroxy-3-oxocholanoic acid,1TMS,isomer#1JsmolC[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@]12CTMS462.3165Semi standard non polar3384.021
7-Hydroxy-3-oxocholanoic acid,1TMS,isomer#2JsmolC[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@]12CTMS462.3165Semi standard non polar3365.3398
7-Hydroxy-3-oxocholanoic acid,1TMS,isomer#3JsmolC[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@]12CTMS462.3165Semi standard non polar3402.2622
7-Hydroxy-3-oxocholanoic acid,1TMS,isomer#4JsmolC[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@]12CTMS462.3165Semi standard non polar3371.059
7-Hydroxy-3-oxocholanoic acid,2TMS,isomer#1JsmolC[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@]12CTMS534.3561Semi standard non polar3278.3413
7-Hydroxy-3-oxocholanoic acid,2TMS,isomer#2JsmolC[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@]12CTMS534.3561Semi standard non polar3345.294
7-Hydroxy-3-oxocholanoic acid,2TMS,isomer#3JsmolC[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@]12CTMS534.3561Semi standard non polar3322.0706
7-Hydroxy-3-oxocholanoic acid,2TMS,isomer#4JsmolC[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@]12CTMS534.3561Semi standard non polar3318.333
7-Hydroxy-3-oxocholanoic acid,2TMS,isomer#5JsmolC[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@]12CTMS534.3561Semi standard non polar3283.9077
7-Hydroxy-3-oxocholanoic acid,1TBDMS,isomer#1JsmolC[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@]12CTBDMS504.3635Semi standard non polar3647.8186
7-Hydroxy-3-oxocholanoic acid,1TBDMS,isomer#2JsmolC[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@]12CTBDMS504.3635Semi standard non polar3588.631
7-Hydroxy-3-oxocholanoic acid,1TBDMS,isomer#3JsmolC[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@]12CTBDMS504.3635Semi standard non polar3650.7056
7-Hydroxy-3-oxocholanoic acid,1TBDMS,isomer#4JsmolC[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@]12CTBDMS504.3635Semi standard non polar3595.125
7-Hydroxy-3-oxocholanoic acid,2TBDMS,isomer#1JsmolC[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@]12CTBDMS618.45Semi standard non polar3762.5356
7-Hydroxy-3-oxocholanoic acid,2TBDMS,isomer#2JsmolC[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@]12CTBDMS618.45Semi standard non polar3820.6392
7-Hydroxy-3-oxocholanoic acid,2TBDMS,isomer#3JsmolC[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@]12CTBDMS618.45Semi standard non polar3779.8071
7-Hydroxy-3-oxocholanoic acid,2TBDMS,isomer#4JsmolC[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@]12CTBDMS618.45Semi standard non polar3742.2725
7-Hydroxy-3-oxocholanoic acid,2TBDMS,isomer#5JsmolC[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@]12CTBDMS618.45Semi standard non polar3688.231
7-Hydroxy-3-oxocholanoic acidJsmol[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@]12CUnderivatized390.277Standard polar3683.8118
7-Hydroxy-3-oxocholanoic acid,3TMS,isomer#1JsmolC[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@]12CTMS606.3956Standard non polar3324.7854
7-Hydroxy-3-oxocholanoic acid,3TMS,isomer#2JsmolC[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@]12CTMS606.3956Standard non polar3337.9458
7-Hydroxy-3-oxocholanoic acid,3TBDMS,isomer#1JsmolC[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@]12CTBDMS732.5364Standard non polar3828.6895
7-Hydroxy-3-oxocholanoic acid,3TBDMS,isomer#2JsmolC[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@]12CTBDMS732.5364Standard non polar3901.6362
7-Hydroxy-3-oxocholanoic acidJsmol[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@]12CUnderivatized390.277Standard non polar3318.691
7-Hydroxy-3-oxocholanoic acidJsmol[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@]12CUnderivatized390.277Semi standard non polar3484.8513
Displaying retention index compounds 22276 - 22300 of 1722868 in total