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(2E,4E)-2-Fluoroabscisic acid ethyl ester
SpectraBase Compound ID 6uiWclMWmMW
InChI InChI=1S/C17H23FO4/c1-6-22-15(20)14(18)11(2)7-8-17(21)12(3)9-13(19)10-16(17,4)5/h7-9,21H,6,10H2,1-5H3/b8-7+,14-11+
InChIKey LHLJVIIBYLSTDI-DQBULIGTSA-N
Mol Weight 310.37 g/mol
Molecular Formula C17H23FO4
Exact Mass 310.158037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lOHVeYG7Oe
Name (2E,4E)-2-Fluoroabscisic acid ethyl ester
Alternate Name(s) Ethyl (2E,4E)-2-fluoro-5-(1-hydroxy-2,6,6-trimethyl-4-oxo-2-cyclohexen-1-yl)-3-methyl-2,4-pentadienoate
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Formula C17H23FO4
InChI InChI=1S/C17H23FO4/c1-6-22-15(20)14(18)11(2)7-8-17(21)12(3)9-13(19)10-16(17,4)5/h7-9,21H,6,10H2,1-5H3/b8-7+,14-11+
InChIKey LHLJVIIBYLSTDI-DQBULIGTSA-N
Molecular Weight 310.365 g/mol
SMILES OC1(C(=CC(CC1(C)C)=O)C)\C=C\C(=C/(C(=O)OCC)F)C
SPLASH splash10-0pc0-0690000000-3634be7adfcc467ec832
Source of Spectrum AT-38-1798-6
Wiley ID 853802