RI00013401 | Phosphoenolpyruvic acid | JsmolOC(=O)C(=C)OP(O)(O)=O | Underivatized | 167.9824 | Standard non polar | 1284.655 |
RI00013402 | Phosphoenolpyruvic acid | JsmolOC(=O)C(=C)OP(O)(O)=O | Underivatized | 167.9824 | Semi standard non polar | 1402.8691 |
RI00013403 | Phosphoenolpyruvic acid,2TMS,isomer#1 | JsmolC=C(OP(=O)(O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C | TMS | 312.0614 | Semi standard non polar | 1530.4453 |
RI00013404 | Phosphoenolpyruvic acid,2TMS,isomer#2 | JsmolC=C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O | TMS | 312.0614 | Semi standard non polar | 1564.5673 |
RI00013405 | Phosphoenolpyruvic acid,3TMS,isomer#1 | JsmolC=C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C | TMS | 384.101 | Semi standard non polar | 1615.6921 |
RI00013406 | Phosphoenolpyruvic acid,2TBDMS,isomer#1 | JsmolC=C(OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C | TBDMS | 396.1553 | Semi standard non polar | 1966.1146 |
RI00013407 | Phosphoenolpyruvic acid,2TBDMS,isomer#2 | JsmolC=C(OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O | TBDMS | 396.1553 | Semi standard non polar | 1981.9686 |
RI00013408 | Phosphoenolpyruvic acid,3TBDMS,isomer#1 | JsmolC=C(OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C | TBDMS | 510.2418 | Semi standard non polar | 2198.0593 |
RI00013409 | Phosphoenolpyruvic acid,2TMS,isomer#1 | JsmolC=C(OP(=O)(O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C | TMS | 312.0614 | Standard polar | 1930.4421 |
RI00013410 | Phosphoenolpyruvic acid,2TMS,isomer#2 | JsmolC=C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O | TMS | 312.0614 | Standard polar | 1819.7932 |
RI00013411 | Phosphoenolpyruvic acid,3TMS,isomer#1 | JsmolC=C(OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C | TMS | 384.101 | Standard polar | 1718.0114 |
RI00013412 | Phosphoenolpyruvic acid,2TBDMS,isomer#1 | JsmolC=C(OP(=O)(O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C | TBDMS | 396.1553 | Standard polar | 2197.629 |
RI00013413 | Phosphoenolpyruvic acid,2TBDMS,isomer#2 | JsmolC=C(OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O | TBDMS | 396.1553 | Standard polar | 2084.1804 |
RI00013414 | Phosphoenolpyruvic acid,3TBDMS,isomer#1 | JsmolC=C(OP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C | TBDMS | 510.2418 | Standard polar | 2102.7185 |
RI00013415 | Liothyronine,1TMS,isomer#1 | JsmolC[Si](C)(C)OC1=CC=C(OC2=C(I)C=C(C[C@H](N)C(=O)O)C=C2I)C=C1I | TMS | 722.8296 | Semi standard non polar | 3500.9255 |
RI00013416 | Liothyronine,1TMS,isomer#2 | JsmolC[Si](C)(C)OC(=O)[C@@H](N)CC1=CC(I)=C(OC2=CC=C(O)C(I)=C2)C(I)=C1 | TMS | 722.8296 | Semi standard non polar | 3505.5237 |
RI00013417 | Liothyronine,1TMS,isomer#3 | JsmolC[Si](C)(C)N[C@@H](CC1=CC(I)=C(OC2=CC=C(O)C(I)=C2)C(I)=C1)C(=O)O | TMS | 722.8296 | Semi standard non polar | 3540.3633 |
RI00013418 | Liothyronine,2TMS,isomer#1 | JsmolC[Si](C)(C)OC(=O)[C@@H](N)CC1=CC(I)=C(OC2=CC=C(O[Si](C)(C)C)C(I)=C2)C(I)=C1 | TMS | 794.8691 | Semi standard non polar | 3520.6355 |
RI00013419 | Liothyronine,2TMS,isomer#2 | JsmolC[Si](C)(C)N[C@@H](CC1=CC(I)=C(OC2=CC=C(O[Si](C)(C)C)C(I)=C2)C(I)=C1)C(=O)O | TMS | 794.8691 | Semi standard non polar | 3516.7683 |
RI00013420 | Liothyronine,2TMS,isomer#3 | JsmolC[Si](C)(C)N[C@@H](CC1=CC(I)=C(OC2=CC=C(O)C(I)=C2)C(I)=C1)C(=O)O[Si](C)(C)C | TMS | 794.8691 | Semi standard non polar | 3485.1895 |
RI00013421 | Liothyronine,2TMS,isomer#4 | JsmolC[Si](C)(C)N([C@@H](CC1=CC(I)=C(OC2=CC=C(O)C(I)=C2)C(I)=C1)C(=O)O)[Si](C)(C)C | TMS | 794.8691 | Semi standard non polar | 3627.2024 |
RI00013422 | Liothyronine,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC1=CC=C(OC2=C(I)C=C(C[C@H](N)C(=O)O)C=C2I)C=C1I | TBDMS | 764.8765 | Semi standard non polar | 3786.6057 |
RI00013423 | Liothyronine,1TBDMS,isomer#2 | JsmolCC(C)(C)[Si](C)(C)OC(=O)[C@@H](N)CC1=CC(I)=C(OC2=CC=C(O)C(I)=C2)C(I)=C1 | TBDMS | 764.8765 | Semi standard non polar | 3777.3384 |
RI00013424 | Liothyronine,1TBDMS,isomer#3 | JsmolCC(C)(C)[Si](C)(C)N[C@@H](CC1=CC(I)=C(OC2=CC=C(O)C(I)=C2)C(I)=C1)C(=O)O | TBDMS | 764.8765 | Semi standard non polar | 3786.9187 |
RI00013425 | Liothyronine,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC(=O)[C@@H](N)CC1=CC(I)=C(OC2=CC=C(O[Si](C)(C)C(C)(C)C)C(I)=C2)C(I)=C1 | TBDMS | 878.963 | Semi standard non polar | 4009.338 |