RI00000201 | Cortexolone,3TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)OC1=CC[C@@]2(C)C(=C1)CC[C@H]1[C@@H]3CC[C@](O[Si](C)(C)C(C)(C)C)(C(=CO)O[Si](C)(C)C(C)(C)C)[C@@]3(C)CC[C@@H]12 | TBDMS | 688.4738 | Standard non polar | 3673.6357 |
RI00000202 | Cortexolone,3TBDMS,isomer#4 | JsmolCC(C)(C)[Si](C)(C)OC=C(O[Si](C)(C)C(C)(C)C)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@@]21C | TBDMS | 688.4738 | Standard non polar | 3720.1294 |
RI00000203 | Cortexolone,4TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC=C(O[Si](C)(C)C(C)(C)C)[C@@]1(O[Si](C)(C)C(C)(C)C)CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@@]21C | TBDMS | 802.5603 | Standard non polar | 3882.7249 |
RI00000204 | Cortexolone | Jsmol[H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C | Underivatized | 346.2144 | Standard non polar | 2850.8604 |
RI00000205 | Cortexolone | Jsmol[H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C | Underivatized | 346.2144 | Semi standard non polar | 3169.0522 |
RI00000206 | Cortexolone,3TMS,isomer#1 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CC[C@]2(O[Si](C)(C)C)C(=O)CO[Si](C)(C)C | TMS | 562.333 | Semi standard non polar | 3251.6897 |
RI00000207 | Cortexolone,3TMS,isomer#2 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@]2(O[Si](C)(C)C)C(=CO[Si](C)(C)C)O[Si](C)(C)C | TMS | 562.333 | Semi standard non polar | 3296.4827 |
RI00000208 | Cortexolone,3TMS,isomer#3 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CC[C@]2(O[Si](C)(C)C)C(=CO)O[Si](C)(C)C | TMS | 562.333 | Semi standard non polar | 3156.03 |
RI00000209 | Cortexolone,3TMS,isomer#4 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CC[C@]2(O)C(=CO[Si](C)(C)C)O[Si](C)(C)C | TMS | 562.333 | Semi standard non polar | 3133.3567 |
RI00000210 | Cortexolone,4TMS,isomer#1 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CC[C@]2(O[Si](C)(C)C)C(=CO[Si](C)(C)C)O[Si](C)(C)C | TMS | 634.3725 | Semi standard non polar | 3190.0383 |
RI00000211 | Cortexolone,3TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC=C(O[Si](C)(C)C(C)(C)C)[C@@]1(O[Si](C)(C)C(C)(C)C)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C | TBDMS | 688.4738 | Semi standard non polar | 4015.9014 |
RI00000212 | Cortexolone,3TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)OCC(=O)[C@@]1(O[Si](C)(C)C(C)(C)C)CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@@]21C | TBDMS | 688.4738 | Semi standard non polar | 3980.6545 |
RI00000213 | Cortexolone,3TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)OC1=CC[C@@]2(C)C(=C1)CC[C@H]1[C@@H]3CC[C@](O[Si](C)(C)C(C)(C)C)(C(=CO)O[Si](C)(C)C(C)(C)C)[C@@]3(C)CC[C@@H]12 | TBDMS | 688.4738 | Semi standard non polar | 3900.5586 |
RI00000214 | Cortexolone,3TBDMS,isomer#4 | JsmolCC(C)(C)[Si](C)(C)OC=C(O[Si](C)(C)C(C)(C)C)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@@]21C | TBDMS | 688.4738 | Semi standard non polar | 3861.4836 |
RI00000215 | Cortexolone,4TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC=C(O[Si](C)(C)C(C)(C)C)[C@@]1(O[Si](C)(C)C(C)(C)C)CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@@]21C | TBDMS | 802.5603 | Semi standard non polar | 4155.298 |
RI00000216 | Cortexolone,3TMS,isomer#1 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CC[C@]2(O[Si](C)(C)C)C(=O)CO[Si](C)(C)C | TMS | 562.333 | Standard polar | 3453.657 |
RI00000217 | Cortexolone,3TMS,isomer#2 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@]2(O[Si](C)(C)C)C(=CO[Si](C)(C)C)O[Si](C)(C)C | TMS | 562.333 | Standard polar | 3438.1677 |
RI00000218 | Cortexolone,3TMS,isomer#3 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CC[C@]2(O[Si](C)(C)C)C(=CO)O[Si](C)(C)C | TMS | 562.333 | Standard polar | 3476.968 |
RI00000219 | Cortexolone,3TMS,isomer#4 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CC[C@]2(O)C(=CO[Si](C)(C)C)O[Si](C)(C)C | TMS | 562.333 | Standard polar | 3516.8606 |
RI00000220 | Cortexolone,4TMS,isomer#1 | JsmolC[C@]12CC[C@H]3[C@@H](CCC4=CC(O[Si](C)(C)C)=CC[C@@]43C)[C@@H]1CC[C@]2(O[Si](C)(C)C)C(=CO[Si](C)(C)C)O[Si](C)(C)C | TMS | 634.3725 | Standard polar | 3412.401 |
RI00000221 | Cortexolone,3TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC=C(O[Si](C)(C)C(C)(C)C)[C@@]1(O[Si](C)(C)C(C)(C)C)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C | TBDMS | 688.4738 | Standard polar | 3695.974 |
RI00000222 | Cortexolone,3TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)OCC(=O)[C@@]1(O[Si](C)(C)C(C)(C)C)CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@@]21C | TBDMS | 688.4738 | Standard polar | 3704.3784 |
RI00000223 | Cortexolone,3TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)OC1=CC[C@@]2(C)C(=C1)CC[C@H]1[C@@H]3CC[C@](O[Si](C)(C)C(C)(C)C)(C(=CO)O[Si](C)(C)C(C)(C)C)[C@@]3(C)CC[C@@H]12 | TBDMS | 688.4738 | Standard polar | 3742.2266 |
RI00000224 | Cortexolone,3TBDMS,isomer#4 | JsmolCC(C)(C)[Si](C)(C)OC=C(O[Si](C)(C)C(C)(C)C)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@@]21C | TBDMS | 688.4738 | Standard polar | 3802.0596 |
RI00000225 | Cortexolone,4TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC=C(O[Si](C)(C)C(C)(C)C)[C@@]1(O[Si](C)(C)C(C)(C)C)CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3CC[C@@]21C | TBDMS | 802.5603 | Standard polar | 3670.8376 |