| SpectraBase Compound ID | DyS36C1HJ5L |
|---|---|
| InChI | InChI=1S/C20H26F2O2/c1-14(7-6-8-15(2)13-18(23)24)9-10-17-16(3)20(21,22)12-11-19(17,4)5/h6-10,13H,11-12H2,1-5H3,(H,23,24)/b8-6+,10-9+,14-7+,15-13+ |
| InChIKey | MKEJTKXMLIOTOD-FRCNGJHJSA-N |
| Mol Weight | 336.42 g/mol |
| Molecular Formula | C20H26F2O2 |
| Exact Mass | 336.190086 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | F1rJO1d1IpG |
|---|---|
| Name | 4,4-Difluororetinoic acid |
| CAS Registry Number | 90660-20-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H26F2O2 |
| InChI | InChI=1S/C20H26F2O2/c1-14(7-6-8-15(2)13-18(23)24)9-10-17-16(3)20(21,22)12-11-19(17,4)5/h6-10,13H,11-12H2,1-5H3,(H,23,24)/b8-6+,10-9+,14-7+,15-13+ |
| InChIKey | MKEJTKXMLIOTOD-FRCNGJHJSA-N |
| Molecular Weight | 336.423 g/mol |
| SMILES | OC(\C=C\(\C=C\C=C/(C)\C=C\C1=C(C)C(F)(F)CCC1(C)C)C)=O |
| SPLASH | splash10-03e9-3910000000-abed5bb4252dc5a0f733 |
| Source of Spectrum | W5-1989-36199-29337 |
| Synonyms | (2E,4E,6E,8E)-9-(3,3-difluoro-2,6,6-trimethyl-1-cyclohexenyl)-3,7-dimethylnona-2,4,6,8-tetraenoic acid (2E,4E,6E,8E)-9-(3,3-difluoro-2,6,6-trimethyl-cyclohexen-1-yl)-3,7-dimethyl-nona-2,4,6,8-tetraenoic acid (2E,4E,6E,8E)-9-[3,3-bis(fluoranyl)-2,6,6-trimethyl-cyclohexen-1-yl]-3,7-dimethyl-nona-2,4,6,8-tetraenoic acid 4,4-Difluororetinoic acid (all-trans) DFRA Retinoic acid, 4,4-difluoro- |
| Wiley ID | 1332532 |