Browsing Retention Index for different Chemical Structures

Displaying retention index compounds 15401 - 15425 of 1722868 in total
RIpred ID Structure Name Chemical Structure Derivatization Type
Base compound Mass 		GC Column/Stationary Phase Retention Index
RI00015401Vanillylmandelic acidJsmolCOC1=C(O)C=CC(=C1)[C@H](O)C(O)=OUnderivatized198.0528Standard polar3318.202
RI00015402Vanillylmandelic acidJsmolCOC1=C(O)C=CC(=C1)[C@H](O)C(O)=OUnderivatized198.0528Standard non polar1822.675
RI00015403Vanillylmandelic acidJsmolCOC1=C(O)C=CC(=C1)[C@H](O)C(O)=OUnderivatized198.0528Semi standard non polar1769.8531
RI00015404XanthineJsmolO=C1NC2=C(NC=N2)C(=O)N1Underivatized152.0334Standard polar2748.7039
RI00015405Xanthine,1TMS,isomer#1JsmolC[Si](C)(C)N1C(=O)[NH]C(=O)C2=C1N=C[NH]2TMS224.073Standard non polar2049.1938
RI00015406Xanthine,1TMS,isomer#2JsmolC[Si](C)(C)N1C=NC2=C1C(=O)[NH]C(=O)[NH]2TMS224.073Standard non polar2038.1906
RI00015407Xanthine,1TMS,isomer#3JsmolC[Si](C)(C)N1C(=O)[NH]C2=C([NH]C=N2)C1=OTMS224.073Standard non polar2112.9148
RI00015408Xanthine,2TMS,isomer#1JsmolC[Si](C)(C)N1C(=O)C2=C(N=C[NH]2)N([Si](C)(C)C)C1=OTMS296.1125Standard non polar2120.9902
RI00015409Xanthine,2TMS,isomer#2JsmolC[Si](C)(C)N1C=NC2=C1C(=O)[NH]C(=O)N2[Si](C)(C)CTMS296.1125Standard non polar2080.8748
RI00015410Xanthine,2TMS,isomer#3JsmolC[Si](C)(C)N1C(=O)[NH]C2=C(C1=O)N([Si](C)(C)C)C=N2TMS296.1125Standard non polar2112.8418
RI00015411Xanthine,3TMS,isomer#1JsmolC[Si](C)(C)N1C(=O)C2=C(N=CN2[Si](C)(C)C)N([Si](C)(C)C)C1=OTMS368.152Standard non polar2081.7913
RI00015412Xanthine,1TBDMS,isomer#1JsmolCC(C)(C)[Si](C)(C)N1C(=O)[NH]C(=O)C2=C1N=C[NH]2TBDMS266.1199Standard non polar2274.4143
RI00015413Xanthine,1TBDMS,isomer#2JsmolCC(C)(C)[Si](C)(C)N1C=NC2=C1C(=O)[NH]C(=O)[NH]2TBDMS266.1199Standard non polar2267.8115
RI00015414Xanthine,1TBDMS,isomer#3JsmolCC(C)(C)[Si](C)(C)N1C(=O)[NH]C2=C([NH]C=N2)C1=OTBDMS266.1199Standard non polar2293.2766
RI00015415Xanthine,2TBDMS,isomer#1JsmolCC(C)(C)[Si](C)(C)N1C(=O)C2=C(N=C[NH]2)N([Si](C)(C)C(C)(C)C)C1=OTBDMS380.2064Standard non polar2493.8555
RI00015416Xanthine,2TBDMS,isomer#2JsmolCC(C)(C)[Si](C)(C)N1C=NC2=C1C(=O)[NH]C(=O)N2[Si](C)(C)C(C)(C)CTBDMS380.2064Standard non polar2480.7144
RI00015417Xanthine,2TBDMS,isomer#3JsmolCC(C)(C)[Si](C)(C)N1C(=O)[NH]C2=C(C1=O)N([Si](C)(C)C(C)(C)C)C=N2TBDMS380.2064Standard non polar2509.5984
RI00015418Xanthine,3TBDMS,isomer#1JsmolCC(C)(C)[Si](C)(C)N1C(=O)C2=C(N=CN2[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)C1=OTBDMS494.2929Standard non polar2729.4724
RI00015419XanthineJsmolO=C1NC2=C(NC=N2)C(=O)N1Underivatized152.0334Standard non polar1757.7384
RI00015420XanthineJsmolO=C1NC2=C(NC=N2)C(=O)N1Underivatized152.0334Semi standard non polar2200.6628
RI00015421Xanthine,1TMS,isomer#1JsmolC[Si](C)(C)N1C(=O)[NH]C(=O)C2=C1N=C[NH]2TMS224.073Semi standard non polar1880.9608
RI00015422Xanthine,1TMS,isomer#2JsmolC[Si](C)(C)N1C=NC2=C1C(=O)[NH]C(=O)[NH]2TMS224.073Semi standard non polar1932.3923
RI00015423Xanthine,1TMS,isomer#3JsmolC[Si](C)(C)N1C(=O)[NH]C2=C([NH]C=N2)C1=OTMS224.073Semi standard non polar1878.4082
RI00015424Xanthine,2TMS,isomer#1JsmolC[Si](C)(C)N1C(=O)C2=C(N=C[NH]2)N([Si](C)(C)C)C1=OTMS296.1125Semi standard non polar1973.2706
RI00015425Xanthine,2TMS,isomer#2JsmolC[Si](C)(C)N1C=NC2=C1C(=O)[NH]C(=O)N2[Si](C)(C)CTMS296.1125Semi standard non polar1929.8555
Displaying retention index compounds 15401 - 15425 of 1722868 in total