Displaying retention index compounds 1751 - 1775 of 1722868 in total
RIpred ID Structure Name Chemical Structure Derivatization Type
Base compound Mass
GC Column/Stationary Phase Retention Index
Ubrogepant,1TMS,isomer#2JsmolC[C@@H]1[C@H](C2=CC=CC=C2)C[C@H](NC(=O)C2=CN=C3C[C@]4(CC3=C2)C(=O)N([Si](C)(C)C)C2=NC=CC=C24)C(=O)N1CC(F)(F)FTMS621.2383Semi standard non polar3903.7722
Ubrogepant,1TMS,isomer#1JsmolC[C@@H]1[C@H](C2=CC=CC=C2)C[C@H](N(C(=O)C2=CN=C3C[C@]4(CC3=C2)C(=O)NC2=NC=CC=C24)[Si](C)(C)C)C(=O)N1CC(F)(F)FTMS621.2383Semi standard non polar4021.3545
Ubrogepant,2TBDMS,isomer#1JsmolC[C@@H]1[C@H](C2=CC=CC=C2)C[C@H](N(C(=O)C2=CN=C3C[C@]4(CC3=C2)C(=O)N([Si](C)(C)C(C)(C)C)C2=NC=CC=C24)[Si](C)(C)C(C)(C)C)C(=O)N1CC(F)(F)FTBDMS777.3717Standard non polar4359.4834
Ubrogepant,1TBDMS,isomer#2JsmolC[C@@H]1[C@H](C2=CC=CC=C2)C[C@H](NC(=O)C2=CN=C3C[C@]4(CC3=C2)C(=O)N([Si](C)(C)C(C)(C)C)C2=NC=CC=C24)C(=O)N1CC(F)(F)FTBDMS663.2853Standard non polar4078.4575
Ubrogepant,1TBDMS,isomer#1JsmolC[C@@H]1[C@H](C2=CC=CC=C2)C[C@H](N(C(=O)C2=CN=C3C[C@]4(CC3=C2)C(=O)NC2=NC=CC=C24)[Si](C)(C)C(C)(C)C)C(=O)N1CC(F)(F)FTBDMS663.2853Standard non polar4139.2
Ubrogepant,2TMS,isomer#1JsmolC[C@@H]1[C@H](C2=CC=CC=C2)C[C@H](N(C(=O)C2=CN=C3C[C@]4(CC3=C2)C(=O)N([Si](C)(C)C)C2=NC=CC=C24)[Si](C)(C)C)C(=O)N1CC(F)(F)FTMS693.2778Standard non polar3958.681
Ubrogepant,1TMS,isomer#2JsmolC[C@@H]1[C@H](C2=CC=CC=C2)C[C@H](NC(=O)C2=CN=C3C[C@]4(CC3=C2)C(=O)N([Si](C)(C)C)C2=NC=CC=C24)C(=O)N1CC(F)(F)FTMS621.2383Standard non polar3872.3894
Ubrogepant,1TMS,isomer#1JsmolC[C@@H]1[C@H](C2=CC=CC=C2)C[C@H](N(C(=O)C2=CN=C3C[C@]4(CC3=C2)C(=O)NC2=NC=CC=C24)[Si](C)(C)C)C(=O)N1CC(F)(F)FTMS621.2383Standard non polar3928.4958
Elexacaftor/Ivacaftor/Tezacaftor,1TBDMS,isomer#1JsmolCC1=NN(C)C=C1S(=O)(=O)N(C(=O)C1=CC=C(N2C=CC(OCC(C)(C)C(F)(F)F)=N2)N=C1N1C[C@@H](C)CC1(C)C)[Si](C)(C)C(C)(C)CTBDMS711.321Standard polar4810.203
Elexacaftor/Ivacaftor/Tezacaftor,1TMS,isomer#1JsmolCC1=NN(C)C=C1S(=O)(=O)N(C(=O)C1=CC=C(N2C=CC(OCC(C)(C)C(F)(F)F)=N2)N=C1N1C[C@@H](C)CC1(C)C)[Si](C)(C)CTMS669.274Standard polar4798.5513
Elexacaftor/Ivacaftor/Tezacaftor,1TBDMS,isomer#1JsmolCC1=NN(C)C=C1S(=O)(=O)N(C(=O)C1=CC=C(N2C=CC(OCC(C)(C)C(F)(F)F)=N2)N=C1N1C[C@@H](C)CC1(C)C)[Si](C)(C)C(C)(C)CTBDMS711.321Semi standard non polar3988.881
Elexacaftor/Ivacaftor/Tezacaftor,1TMS,isomer#1JsmolCC1=NN(C)C=C1S(=O)(=O)N(C(=O)C1=CC=C(N2C=CC(OCC(C)(C)C(F)(F)F)=N2)N=C1N1C[C@@H](C)CC1(C)C)[Si](C)(C)CTMS669.274Semi standard non polar3798.845
Elexacaftor/Ivacaftor/Tezacaftor,1TBDMS,isomer#1JsmolCC1=NN(C)C=C1S(=O)(=O)N(C(=O)C1=CC=C(N2C=CC(OCC(C)(C)C(F)(F)F)=N2)N=C1N1C[C@@H](C)CC1(C)C)[Si](C)(C)C(C)(C)CTBDMS711.321Standard non polar4585.565
Elexacaftor/Ivacaftor/Tezacaftor,1TMS,isomer#1JsmolCC1=NN(C)C=C1S(=O)(=O)N(C(=O)C1=CC=C(N2C=CC(OCC(C)(C)C(F)(F)F)=N2)N=C1N1C[C@@H](C)CC1(C)C)[Si](C)(C)CTMS669.274Standard non polar4339.5815
Entrectinib,2TBDMS,isomer#3JsmolCN1CCN(C2=CC=C(C(=O)NC3=NN([Si](C)(C)C(C)(C)C)C4=CC=C(CC5=CC(F)=CC(F)=C5)C=C34)C(N(C3CCOCC3)[Si](C)(C)C(C)(C)C)=C2)CC1TBDMS788.4441Standard polar5730.6694
Entrectinib,2TBDMS,isomer#2JsmolCN1CCN(C2=CC=C(C(=O)N(C3=N[NH]C4=CC=C(CC5=CC(F)=CC(F)=C5)C=C34)[Si](C)(C)C(C)(C)C)C(N(C3CCOCC3)[Si](C)(C)C(C)(C)C)=C2)CC1TBDMS788.4441Standard polar5639.997
Entrectinib,2TBDMS,isomer#1JsmolCN1CCN(C2=CC=C(C(=O)N(C3=NN([Si](C)(C)C(C)(C)C)C4=CC=C(CC5=CC(F)=CC(F)=C5)C=C34)[Si](C)(C)C(C)(C)C)C(NC3CCOCC3)=C2)CC1TBDMS788.4441Standard polar5653.175
Entrectinib,1TBDMS,isomer#3JsmolCN1CCN(C2=CC=C(C(=O)NC3=N[NH]C4=CC=C(CC5=CC(F)=CC(F)=C5)C=C34)C(N(C3CCOCC3)[Si](C)(C)C(C)(C)C)=C2)CC1TBDMS674.3576Standard polar6139.158
Entrectinib,1TBDMS,isomer#2JsmolCN1CCN(C2=CC=C(C(=O)NC3=NN([Si](C)(C)C(C)(C)C)C4=CC=C(CC5=CC(F)=CC(F)=C5)C=C34)C(NC3CCOCC3)=C2)CC1TBDMS674.3576Standard polar6015.4614
Entrectinib,1TBDMS,isomer#1JsmolCN1CCN(C2=CC=C(C(=O)N(C3=N[NH]C4=CC=C(CC5=CC(F)=CC(F)=C5)C=C34)[Si](C)(C)C(C)(C)C)C(NC3CCOCC3)=C2)CC1TBDMS674.3576Standard polar5921.189
Entrectinib,3TMS,isomer#1JsmolCN1CCN(C2=CC=C(C(=O)N(C3=NN([Si](C)(C)C)C4=CC=C(CC5=CC(F)=CC(F)=C5)C=C34)[Si](C)(C)C)C(N(C3CCOCC3)[Si](C)(C)C)=C2)CC1TMS776.3897Standard polar5381.2134
Entrectinib,2TMS,isomer#3JsmolCN1CCN(C2=CC=C(C(=O)NC3=NN([Si](C)(C)C)C4=CC=C(CC5=CC(F)=CC(F)=C5)C=C34)C(N(C3CCOCC3)[Si](C)(C)C)=C2)CC1TMS704.3502Standard polar5748.91
Entrectinib,2TMS,isomer#2JsmolCN1CCN(C2=CC=C(C(=O)N(C3=N[NH]C4=CC=C(CC5=CC(F)=CC(F)=C5)C=C34)[Si](C)(C)C)C(N(C3CCOCC3)[Si](C)(C)C)=C2)CC1TMS704.3502Standard polar5616.061
Entrectinib,2TMS,isomer#1JsmolCN1CCN(C2=CC=C(C(=O)N(C3=NN([Si](C)(C)C)C4=CC=C(CC5=CC(F)=CC(F)=C5)C=C34)[Si](C)(C)C)C(NC3CCOCC3)=C2)CC1TMS704.3502Standard polar5670.2373
Entrectinib,1TMS,isomer#3JsmolCN1CCN(C2=CC=C(C(=O)NC3=N[NH]C4=CC=C(CC5=CC(F)=CC(F)=C5)C=C34)C(N(C3CCOCC3)[Si](C)(C)C)=C2)CC1TMS632.3107Standard polar6120.914
Displaying retention index compounds 1751 - 1775 of 1722868 in total