RI01711426 | betanidin quinone,1TMS,isomer#1 | JsmolC[Si](C)(C)N1C(C(=O)[O-])=CC(=CC=[N+]2C3=CC(=O)C(=O)C=C3CC2C(=O)[O-])CC1C(=O)[O-] | TMS | 456.1 | Semi standard non polar | 3459.3884 |
RI01711425 | betanidin quinone,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)N1C(C(=O)[O-])=CC(=CC=[N+]2C3=CC(=O)C(=O)C=C3CC2C(=O)[O-])CC1C(=O)[O-] | TBDMS | 498.1469 | Standard non polar | 3477.5874 |
RI01711424 | betanidin quinone,1TMS,isomer#1 | JsmolC[Si](C)(C)N1C(C(=O)[O-])=CC(=CC=[N+]2C3=CC(=O)C(=O)C=C3CC2C(=O)[O-])CC1C(=O)[O-] | TMS | 456.1 | Standard non polar | 3254.6694 |
RI01711423 | betalamate,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)N1C(C(=O)[O-])=CC(=CC=O)CC1C(=O)[O-] | TBDMS | 323.12 | Standard polar | 2826.9507 |
RI01711422 | betalamate,1TMS,isomer#1 | JsmolC[Si](C)(C)N1C(C(=O)[O-])=CC(=CC=O)CC1C(=O)[O-] | TMS | 281.073 | Standard polar | 2728.3093 |
RI01711421 | betalamate,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)N1C(C(=O)[O-])=CC(=CC=O)CC1C(=O)[O-] | TBDMS | 323.12 | Semi standard non polar | 2153.0642 |
RI01711420 | betalamate,1TMS,isomer#1 | JsmolC[Si](C)(C)N1C(C(=O)[O-])=CC(=CC=O)CC1C(=O)[O-] | TMS | 281.073 | Semi standard non polar | 1896.3499 |
RI01711419 | betalamate,1TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)N1C(C(=O)[O-])=CC(=CC=O)CC1C(=O)[O-] | TBDMS | 323.12 | Standard non polar | 1967.3344 |
RI01711418 | betalamate,1TMS,isomer#1 | JsmolC[Si](C)(C)N1C(C(=O)[O-])=CC(=CC=O)CC1C(=O)[O-] | TMS | 281.073 | Standard non polar | 1749.0704 |
RI01711417 | benzyl-6-hydroxy-2-cyclohexene-on-oyl,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC1=CCC=CC1(O[Si](C)(C)C(C)(C)C)C(=O)OCC1=CC=CC=C1 | TBDMS | 474.2622 | Standard polar | 2780.4844 |
RI01711416 | benzyl-6-hydroxy-2-cyclohexene-on-oyl,2TMS,isomer#1 | JsmolC[Si](C)(C)OC1=CCC=CC1(O[Si](C)(C)C)C(=O)OCC1=CC=CC=C1 | TMS | 390.1683 | Standard polar | 2612.3428 |
RI01711415 | benzyl-6-hydroxy-2-cyclohexene-on-oyl,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC1=CCC=CC1(O[Si](C)(C)C(C)(C)C)C(=O)OCC1=CC=CC=C1 | TBDMS | 474.2622 | Semi standard non polar | 2535.0225 |
RI01711414 | benzyl-6-hydroxy-2-cyclohexene-on-oyl,2TMS,isomer#1 | JsmolC[Si](C)(C)OC1=CCC=CC1(O[Si](C)(C)C)C(=O)OCC1=CC=CC=C1 | TMS | 390.1683 | Semi standard non polar | 2059.331 |
RI01711413 | benzyl-6-hydroxy-2-cyclohexene-on-oyl,2TBDMS,isomer#1 | JsmolCC(C)(C)[Si](C)(C)OC1=CCC=CC1(O[Si](C)(C)C(C)(C)C)C(=O)OCC1=CC=CC=C1 | TBDMS | 474.2622 | Standard non polar | 2353.2332 |
RI01711412 | benzyl-6-hydroxy-2-cyclohexene-on-oyl,2TMS,isomer#1 | JsmolC[Si](C)(C)OC1=CCC=CC1(O[Si](C)(C)C)C(=O)OCC1=CC=CC=C1 | TMS | 390.1683 | Standard non polar | 2024.5802 |
RI01711411 | avenastenone,1TBDMS,isomer#2 | JsmolCC=C(CCC(C)C1CCC2C3=CCC4C=C(O[Si](C)(C)C(C)(C)C)CCC4(C)C3CCC21C)C(C)C | TBDMS | 524.4413 | Standard polar | 3712.3772 |
RI01711410 | avenastenone,1TBDMS,isomer#1 | JsmolCC=C(CCC(C)C1CCC2C3=CCC4CC(O[Si](C)(C)C(C)(C)C)=CCC4(C)C3CCC21C)C(C)C | TBDMS | 524.4413 | Standard polar | 3686.8848 |
RI01711409 | avenastenone,1TMS,isomer#2 | JsmolCC=C(CCC(C)C1CCC2C3=CCC4C=C(O[Si](C)(C)C)CCC4(C)C3CCC21C)C(C)C | TMS | 482.3944 | Standard polar | 3592.2227 |
RI01711408 | avenastenone,1TMS,isomer#1 | JsmolCC=C(CCC(C)C1CCC2C3=CCC4CC(O[Si](C)(C)C)=CCC4(C)C3CCC21C)C(C)C | TMS | 482.3944 | Standard polar | 3569.3376 |
RI01711407 | avenastenone,1TBDMS,isomer#2 | JsmolCC=C(CCC(C)C1CCC2C3=CCC4C=C(O[Si](C)(C)C(C)(C)C)CCC4(C)C3CCC21C)C(C)C | TBDMS | 524.4413 | Semi standard non polar | 3672.7402 |
RI01711406 | avenastenone,1TBDMS,isomer#1 | JsmolCC=C(CCC(C)C1CCC2C3=CCC4CC(O[Si](C)(C)C(C)(C)C)=CCC4(C)C3CCC21C)C(C)C | TBDMS | 524.4413 | Semi standard non polar | 3672.7688 |
RI01711405 | avenastenone,1TMS,isomer#2 | JsmolCC=C(CCC(C)C1CCC2C3=CCC4C=C(O[Si](C)(C)C)CCC4(C)C3CCC21C)C(C)C | TMS | 482.3944 | Semi standard non polar | 3456.4292 |
RI01711404 | avenastenone,1TMS,isomer#1 | JsmolCC=C(CCC(C)C1CCC2C3=CCC4CC(O[Si](C)(C)C)=CCC4(C)C3CCC21C)C(C)C | TMS | 482.3944 | Semi standard non polar | 3446.2544 |
RI01711403 | avenastenone,1TBDMS,isomer#2 | JsmolCC=C(CCC(C)C1CCC2C3=CCC4C=C(O[Si](C)(C)C(C)(C)C)CCC4(C)C3CCC21C)C(C)C | TBDMS | 524.4413 | Standard non polar | 3530.16 |
RI01711402 | avenastenone,1TBDMS,isomer#1 | JsmolCC=C(CCC(C)C1CCC2C3=CCC4CC(O[Si](C)(C)C(C)(C)C)=CCC4(C)C3CCC21C)C(C)C | TBDMS | 524.4413 | Standard non polar | 3483.7568 |