| SpectraBase Spectrum ID |
ELeb3Sre36E |
| Name |
Methyl 3'-fluoroabscisate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H21FO4 |
| InChI |
InChI=1S/C16H21FO4/c1-10(8-13(19)21-5)6-7-16(20)11(2)14(17)12(18)9-15(16,3)4/h6-8,20H,9H2,1-5H3/b7-6+,10-8-/t16-/m1/s1 |
| InChIKey |
NPBCXLJDGSUEQP-FSXOEFLGSA-N |
| Molecular Weight |
296.338 g/mol |
| SMILES |
O[C@@]1(C(=C(C(CC1(C)C)=O)F)C)\C=C\C(=C/C(=O)OC)C |
| SPLASH |
splash10-0ke9-0930000000-0d310525b71acd4e4290 |
| Source of Spectrum |
F-51-6921-5 |
| Synonyms |
Methyl (2Z,4E)-5-[(1S)-3-fluoro-1-hydroxy-2,6,6-trimethyl-4-oxo-2-cyclohexen-1-yl]-3-methyl-2,4-pentadienoate |
| Wiley ID |
792154 |
