RI01723626 | 2-Aminobenzenesulfonic acid,3TMS,isomer#1 | JsmolC[Si](C)(C)OS(=O)(=O)C1=CC=CC=C1N([Si](C)(C)C)[Si](C)(C)C | TMS | 389.1332 | Standard non polar | 2024.6501 |
RI01723625 | 2-Aminobenzenesulfonic acid,2TMS,isomer#2 | JsmolC[Si](C)(C)N(C1=CC=CC=C1S(=O)(=O)O)[Si](C)(C)C | TMS | 317.0937 | Standard non polar | 1888.7905 |
RI01723624 | 2-Aminobenzenesulfonic acid,2TMS,isomer#1 | JsmolC[Si](C)(C)NC1=CC=CC=C1S(=O)(=O)O[Si](C)(C)C | TMS | 317.0937 | Standard non polar | 1808.0927 |
RI01723623 | 2-Aminobenzenesulfonic acid,1TMS,isomer#2 | JsmolC[Si](C)(C)NC1=CC=CC=C1S(=O)(=O)O | TMS | 245.0542 | Standard non polar | 1667.9999 |
RI01723622 | 2-Aminobenzenesulfonic acid,1TMS,isomer#1 | JsmolC[Si](C)(C)OS(=O)(=O)C1=CC=CC=C1N | TMS | 245.0542 | Standard non polar | 1621.8372 |
RI01723621 | 6-Hydroxyindoxyl sulfate,2TBDMS,isomer#1 | JsmolCC1=CC=C2C(OS(=O)(=O)O[Si](C)(C)C(C)(C)C)=CN([Si](C)(C)C(C)(C)C)C2=C1 | TBDMS | 455.1982 | Standard polar | 2826.9297 |
RI01723620 | 6-Hydroxyindoxyl sulfate,1TBDMS,isomer#2 | JsmolCC1=CC=C2C(OS(=O)(=O)O)=CN([Si](C)(C)C(C)(C)C)C2=C1 | TBDMS | 341.1117 | Standard polar | 3059.303 |
RI01723619 | 6-Hydroxyindoxyl sulfate,1TBDMS,isomer#1 | JsmolCC1=CC=C2C(OS(=O)(=O)O[Si](C)(C)C(C)(C)C)=C[NH]C2=C1 | TBDMS | 341.1117 | Standard polar | 2986.7036 |
RI01723618 | 6-Hydroxyindoxyl sulfate,2TMS,isomer#1 | JsmolCC1=CC=C2C(OS(=O)(=O)O[Si](C)(C)C)=CN([Si](C)(C)C)C2=C1 | TMS | 371.1043 | Standard polar | 2714.426 |
RI01723617 | 6-Hydroxyindoxyl sulfate,1TMS,isomer#2 | JsmolCC1=CC=C2C(OS(=O)(=O)O)=CN([Si](C)(C)C)C2=C1 | TMS | 299.0648 | Standard polar | 3018.9675 |
RI01723616 | 6-Hydroxyindoxyl sulfate,1TMS,isomer#1 | JsmolCC1=CC=C2C(OS(=O)(=O)O[Si](C)(C)C)=C[NH]C2=C1 | TMS | 299.0648 | Standard polar | 2961.3105 |
RI01723615 | 6-Hydroxyindoxyl sulfate,2TBDMS,isomer#1 | JsmolCC1=CC=C2C(OS(=O)(=O)O[Si](C)(C)C(C)(C)C)=CN([Si](C)(C)C(C)(C)C)C2=C1 | TBDMS | 455.1982 | Semi standard non polar | 2591.273 |
RI01723614 | 6-Hydroxyindoxyl sulfate,1TBDMS,isomer#2 | JsmolCC1=CC=C2C(OS(=O)(=O)O)=CN([Si](C)(C)C(C)(C)C)C2=C1 | TBDMS | 341.1117 | Semi standard non polar | 2387.0386 |
RI01723613 | 6-Hydroxyindoxyl sulfate,1TBDMS,isomer#1 | JsmolCC1=CC=C2C(OS(=O)(=O)O[Si](C)(C)C(C)(C)C)=C[NH]C2=C1 | TBDMS | 341.1117 | Semi standard non polar | 2366.1526 |
RI01723612 | 6-Hydroxyindoxyl sulfate,2TMS,isomer#1 | JsmolCC1=CC=C2C(OS(=O)(=O)O[Si](C)(C)C)=CN([Si](C)(C)C)C2=C1 | TMS | 371.1043 | Semi standard non polar | 2160.7656 |
RI01723611 | 6-Hydroxyindoxyl sulfate,1TMS,isomer#2 | JsmolCC1=CC=C2C(OS(=O)(=O)O)=CN([Si](C)(C)C)C2=C1 | TMS | 299.0648 | Semi standard non polar | 2141.419 |
RI01723610 | 6-Hydroxyindoxyl sulfate,1TMS,isomer#1 | JsmolCC1=CC=C2C(OS(=O)(=O)O[Si](C)(C)C)=C[NH]C2=C1 | TMS | 299.0648 | Semi standard non polar | 2080.7563 |
RI01723609 | 6-Hydroxyindoxyl sulfate,2TBDMS,isomer#1 | JsmolCC1=CC=C2C(OS(=O)(=O)O[Si](C)(C)C(C)(C)C)=CN([Si](C)(C)C(C)(C)C)C2=C1 | TBDMS | 455.1982 | Standard non polar | 2691.0222 |
RI01723608 | 6-Hydroxyindoxyl sulfate,1TBDMS,isomer#2 | JsmolCC1=CC=C2C(OS(=O)(=O)O)=CN([Si](C)(C)C(C)(C)C)C2=C1 | TBDMS | 341.1117 | Standard non polar | 2367.1511 |
RI01723607 | 6-Hydroxyindoxyl sulfate,1TBDMS,isomer#1 | JsmolCC1=CC=C2C(OS(=O)(=O)O[Si](C)(C)C(C)(C)C)=C[NH]C2=C1 | TBDMS | 341.1117 | Standard non polar | 2301.4702 |
RI01723606 | 6-Hydroxyindoxyl sulfate,2TMS,isomer#1 | JsmolCC1=CC=C2C(OS(=O)(=O)O[Si](C)(C)C)=CN([Si](C)(C)C)C2=C1 | TMS | 371.1043 | Standard non polar | 2219.9233 |
RI01723605 | 6-Hydroxyindoxyl sulfate,1TMS,isomer#2 | JsmolCC1=CC=C2C(OS(=O)(=O)O)=CN([Si](C)(C)C)C2=C1 | TMS | 299.0648 | Standard non polar | 2165.6436 |
RI01723604 | 6-Hydroxyindoxyl sulfate,1TMS,isomer#1 | JsmolCC1=CC=C2C(OS(=O)(=O)O[Si](C)(C)C)=C[NH]C2=C1 | TMS | 299.0648 | Standard non polar | 2053.1367 |
RI01723603 | 5-Hydroxyindoxyl sulfate,2TBDMS,isomer#1 | JsmolCC1=CC=C2C(=C1)C(S(=O)(=O)O[Si](C)(C)C(C)(C)C)=CN2[Si](C)(C)C(C)(C)C | TBDMS | 439.2033 | Standard polar | 2617.397 |
RI01723602 | 5-Hydroxyindoxyl sulfate,1TBDMS,isomer#2 | JsmolCC1=CC=C2C(=C1)C(S(=O)(=O)O)=CN2[Si](C)(C)C(C)(C)C | TBDMS | 325.1168 | Standard polar | 2771.419 |