RI00065651 | N'-Formylkynurenine,2TBDMS,isomer#4 | JsmolCC(C)(C)[Si](C)(C)NC(CC(=O)C1=CC=CC=C1N(C=O)[Si](C)(C)C(C)(C)C)C(=O)O | TBDMS | 464.2527 | Standard non polar | 2777.4736 |
RI00065652 | N'-Formylkynurenine,3TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=O)C(CC(=O)C1=CC=CC=C1NC=O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C | TBDMS | 578.3391 | Standard non polar | 3023.36 |
RI00065653 | N'-Formylkynurenine,3TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)NC(CC(=O)C1=CC=CC=C1N(C=O)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C | TBDMS | 578.3391 | Standard non polar | 2947.7263 |
RI00065654 | N'-Formylkynurenine,3TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)N(C=O)C1=CC=CC=C1C(=O)CC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C | TBDMS | 578.3391 | Standard non polar | 3047.9722 |
RI00065655 | N'-Formylkynurenine,4TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=O)C(CC(=O)C1=CC=CC=C1N(C=O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C | TBDMS | 692.4256 | Standard non polar | 3214.3623 |
RI00065656 | N'-Formylkynurenine | JsmolNC(CC(=O)C1=CC=CC=C1NC=O)C(O)=O | Underivatized | 236.0797 | Semi standard non polar | 2472.564 |
RI00065657 | N'-Formylkynurenine,2TMS,isomer#1 | JsmolC[Si](C)(C)NC(CC(=O)C1=CC=CC=C1NC=O)C(=O)O[Si](C)(C)C | TMS | 380.1588 | Semi standard non polar | 2335.8662 |
RI00065658 | N'-Formylkynurenine,2TMS,isomer#2 | JsmolC[Si](C)(C)OC(=O)C(N)CC(=O)C1=CC=CC=C1N(C=O)[Si](C)(C)C | TMS | 380.1588 | Semi standard non polar | 2206.5576 |
RI00065659 | N'-Formylkynurenine,2TMS,isomer#3 | JsmolC[Si](C)(C)N(C(CC(=O)C1=CC=CC=C1NC=O)C(=O)O)[Si](C)(C)C | TMS | 380.1588 | Semi standard non polar | 2467.954 |
RI00065660 | N'-Formylkynurenine,2TMS,isomer#4 | JsmolC[Si](C)(C)NC(CC(=O)C1=CC=CC=C1N(C=O)[Si](C)(C)C)C(=O)O | TMS | 380.1588 | Semi standard non polar | 2243.9297 |
RI00065661 | N'-Formylkynurenine,3TMS,isomer#1 | JsmolC[Si](C)(C)OC(=O)C(CC(=O)C1=CC=CC=C1NC=O)N([Si](C)(C)C)[Si](C)(C)C | TMS | 452.1983 | Semi standard non polar | 2489.8484 |
RI00065662 | N'-Formylkynurenine,3TMS,isomer#2 | JsmolC[Si](C)(C)NC(CC(=O)C1=CC=CC=C1N(C=O)[Si](C)(C)C)C(=O)O[Si](C)(C)C | TMS | 452.1983 | Semi standard non polar | 2236.9292 |
RI00065663 | N'-Formylkynurenine,3TMS,isomer#3 | JsmolC[Si](C)(C)N(C=O)C1=CC=CC=C1C(=O)CC(C(=O)O)N([Si](C)(C)C)[Si](C)(C)C | TMS | 452.1983 | Semi standard non polar | 2393.1465 |
RI00065664 | N'-Formylkynurenine,4TMS,isomer#1 | JsmolC[Si](C)(C)OC(=O)C(CC(=O)C1=CC=CC=C1N(C=O)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C | TMS | 524.2378 | Semi standard non polar | 2440.859 |
RI00065665 | N'-Formylkynurenine,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)NC(CC(=O)C1=CC=CC=C1NC=O)C(=O)O[Si](C)(C)C(C)(C)C | TBDMS | 464.2527 | Semi standard non polar | 2833.26 |
RI00065666 | N'-Formylkynurenine,2TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)OC(=O)C(N)CC(=O)C1=CC=CC=C1N(C=O)[Si](C)(C)C(C)(C)C | TBDMS | 464.2527 | Semi standard non polar | 2670.1807 |
RI00065667 | N'-Formylkynurenine,2TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)N(C(CC(=O)C1=CC=CC=C1NC=O)C(=O)O)[Si](C)(C)C(C)(C)C | TBDMS | 464.2527 | Semi standard non polar | 2968.492 |
RI00065668 | N'-Formylkynurenine,2TBDMS,isomer#4 | JsmolCC(C)(C)[Si](C)(C)NC(CC(=O)C1=CC=CC=C1N(C=O)[Si](C)(C)C(C)(C)C)C(=O)O | TBDMS | 464.2527 | Semi standard non polar | 2721.5974 |
RI00065669 | N'-Formylkynurenine,3TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=O)C(CC(=O)C1=CC=CC=C1NC=O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C | TBDMS | 578.3391 | Semi standard non polar | 3185.0168 |
RI00065670 | N'-Formylkynurenine,3TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)NC(CC(=O)C1=CC=CC=C1N(C=O)[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C | TBDMS | 578.3391 | Semi standard non polar | 2877.9458 |
RI00065671 | N'-Formylkynurenine,3TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)N(C=O)C1=CC=CC=C1C(=O)CC(C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C | TBDMS | 578.3391 | Semi standard non polar | 3071.441 |
RI00065672 | N'-Formylkynurenine,4TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=O)C(CC(=O)C1=CC=CC=C1N(C=O)[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C | TBDMS | 692.4256 | Semi standard non polar | 3302.075 |
RI00065673 | N'-Formylkynurenine,2TMS,isomer#1 | JsmolC[Si](C)(C)NC(CC(=O)C1=CC=CC=C1NC=O)C(=O)O[Si](C)(C)C | TMS | 380.1588 | Standard polar | 3070.1763 |
RI00065674 | N'-Formylkynurenine,2TMS,isomer#2 | JsmolC[Si](C)(C)OC(=O)C(N)CC(=O)C1=CC=CC=C1N(C=O)[Si](C)(C)C | TMS | 380.1588 | Standard polar | 3034.0432 |
RI00065675 | N'-Formylkynurenine,2TMS,isomer#3 | JsmolC[Si](C)(C)N(C(CC(=O)C1=CC=CC=C1NC=O)C(=O)O)[Si](C)(C)C | TMS | 380.1588 | Standard polar | 3284.6328 |