RI00063501 | 4a-Carboxy-4b-methyl-5a-cholesta-8,24-dien-3b-ol,2TMS,isomer#1 | JsmolCC(C)=CCC[C@@H](C)C1CCC2C3=C(CC[C@@]21C)[C@@]1(C)CC[C@H](O[Si](C)(C)C)[C@@](C)(C(=O)O[Si](C)(C)C)[C@@H]1CC3 | TMS | 586.4237 | Semi standard non polar | 3506.9812 |
RI00063502 | 4a-Carboxy-4b-methyl-5a-cholesta-8,24-dien-3b-ol,1TBDMS,isomer#1 | JsmolCC(C)=CCC[C@@H](C)C1CCC2C3=C(CC[C@@]21C)[C@@]1(C)CC[C@H](O[Si](C)(C)C(C)(C)C)[C@@](C)(C(=O)O)[C@@H]1CC3 | TBDMS | 556.4312 | Semi standard non polar | 3787.9797 |
RI00063503 | 4a-Carboxy-4b-methyl-5a-cholesta-8,24-dien-3b-ol,1TBDMS,isomer#2 | JsmolCC(C)=CCC[C@@H](C)C1CCC2C3=C(CC[C@@]21C)[C@@]1(C)CC[C@H](O)[C@@](C)(C(=O)O[Si](C)(C)C(C)(C)C)[C@@H]1CC3 | TBDMS | 556.4312 | Semi standard non polar | 3755.2717 |
RI00063504 | 4a-Carboxy-4b-methyl-5a-cholesta-8,24-dien-3b-ol,2TBDMS,isomer#1 | JsmolCC(C)=CCC[C@@H](C)C1CCC2C3=C(CC[C@@]21C)[C@@]1(C)CC[C@H](O[Si](C)(C)C(C)(C)C)[C@@](C)(C(=O)O[Si](C)(C)C(C)(C)C)[C@@H]1CC3 | TBDMS | 670.5176 | Semi standard non polar | 3991.4026 |
RI00063505 | 4a-Carboxy-4b-methyl-5a-cholesta-8,24-dien-3b-ol | JsmolC[C@H](CCC=C(C)C)C1CCC2C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)[C@](C)([C@@H]1CC3)C(O)=O | Underivatized | 442.3447 | Standard polar | 3313.0027 |
RI00063506 | 4a-Carboxy-4b-methyl-5a-cholesta-8,24-dien-3b-ol | JsmolC[C@H](CCC=C(C)C)C1CCC2C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)[C@](C)([C@@H]1CC3)C(O)=O | Underivatized | 442.3447 | Standard non polar | 3359.9858 |
RI00063507 | 4a-Carboxy-4b-methyl-5a-cholesta-8,24-dien-3b-ol | JsmolC[C@H](CCC=C(C)C)C1CCC2C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)[C@](C)([C@@H]1CC3)C(O)=O | Underivatized | 442.3447 | Semi standard non polar | 3553.3398 |
RI00063508 | 6,8-Dihydroxypurine | JsmolO=C1NC2=C(N1)C(=O)N=CN2 | Underivatized | 152.0334 | Standard polar | 2609.9375 |
RI00063509 | 6,8-Dihydroxypurine | JsmolO=C1NC2=C(N1)C(=O)N=CN2 | Underivatized | 152.0334 | Standard non polar | 1883.6934 |
RI00063510 | 6,8-Dihydroxypurine,1TMS,isomer#1 | JsmolC[Si](C)(C)N1C(=O)[NH]C2=C1[NH]C=NC2=O | TMS | 224.073 | Standard non polar | 2011.6028 |
RI00063511 | 6,8-Dihydroxypurine,1TMS,isomer#2 | JsmolC[Si](C)(C)N1C(=O)[NH]C2=C1C(=O)N=C[NH]2 | TMS | 224.073 | Standard non polar | 1968.8367 |
RI00063512 | 6,8-Dihydroxypurine,1TMS,isomer#3 | JsmolC[Si](C)(C)N1C=NC(=O)C2=C1[NH]C(=O)[NH]2 | TMS | 224.073 | Standard non polar | 2045.3627 |
RI00063513 | 6,8-Dihydroxypurine,2TMS,isomer#1 | JsmolC[Si](C)(C)N1C(=O)N([Si](C)(C)C)C2=C1[NH]C=NC2=O | TMS | 296.1125 | Standard non polar | 2077.8445 |
RI00063514 | 6,8-Dihydroxypurine,2TMS,isomer#2 | JsmolC[Si](C)(C)N1C=NC(=O)C2=C1N([Si](C)(C)C)C(=O)[NH]2 | TMS | 296.1125 | Standard non polar | 2168.3408 |
RI00063515 | 6,8-Dihydroxypurine,2TMS,isomer#3 | JsmolC[Si](C)(C)N1C=NC(=O)C2=C1[NH]C(=O)N2[Si](C)(C)C | TMS | 296.1125 | Standard non polar | 2129.328 |
RI00063516 | 6,8-Dihydroxypurine,3TMS,isomer#1 | JsmolC[Si](C)(C)N1C=NC(=O)C2=C1N([Si](C)(C)C)C(=O)N2[Si](C)(C)C | TMS | 368.152 | Standard non polar | 2178.7144 |
RI00063517 | 6,8-Dihydroxypurine,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)N1C(=O)[NH]C2=C1[NH]C=NC2=O | TBDMS | 266.1199 | Standard non polar | 2234.4766 |
RI00063518 | 6,8-Dihydroxypurine,1TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)N1C(=O)[NH]C2=C1C(=O)N=C[NH]2 | TBDMS | 266.1199 | Standard non polar | 2196.78 |
RI00063519 | 6,8-Dihydroxypurine,1TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)N1C=NC(=O)C2=C1[NH]C(=O)[NH]2 | TBDMS | 266.1199 | Standard non polar | 2271.9846 |
RI00063520 | 6,8-Dihydroxypurine,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)N1C(=O)N([Si](C)(C)C(C)(C)C)C2=C1[NH]C=NC2=O | TBDMS | 380.2064 | Standard non polar | 2449.2344 |
RI00063521 | 6,8-Dihydroxypurine,2TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)N1C=NC(=O)C2=C1N([Si](C)(C)C(C)(C)C)C(=O)[NH]2 | TBDMS | 380.2064 | Standard non polar | 2564.9565 |
RI00063522 | 6,8-Dihydroxypurine,2TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)N1C=NC(=O)C2=C1[NH]C(=O)N2[Si](C)(C)C(C)(C)C | TBDMS | 380.2064 | Standard non polar | 2512.8215 |
RI00063523 | 6,8-Dihydroxypurine,3TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)N1C=NC(=O)C2=C1N([Si](C)(C)C(C)(C)C)C(=O)N2[Si](C)(C)C(C)(C)C | TBDMS | 494.2929 | Standard non polar | 2742.598 |
RI00063524 | 6,8-Dihydroxypurine | JsmolO=C1NC2=C(N1)C(=O)N=CN2 | Underivatized | 152.0334 | Semi standard non polar | 2147.2026 |
RI00063525 | 6,8-Dihydroxypurine,1TMS,isomer#1 | JsmolC[Si](C)(C)N1C(=O)[NH]C2=C1[NH]C=NC2=O | TMS | 224.073 | Semi standard non polar | 1871.5785 |