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(S,S)-4-Acetoxymethyl-2-(4-fluorophenyl)-1,3-dioxane
SpectraBase Compound ID AryR7y6SFNh
InChI InChI=1S/C13H15FO4/c1-9(15)17-8-12-6-7-16-13(18-12)10-2-4-11(14)5-3-10/h2-5,12-13H,6-8H2,1H3/t12-,13-/m0/s1
InChIKey CHPFCYRPYGRWEK-STQMWFEESA-N
Mol Weight 254.26 g/mol
Molecular Formula C13H15FO4
Exact Mass 254.095437 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID RsYt8ZWsfw
Name (S,S)-4-Acetoxymethyl-2-(4-fluorophenyl)-1,3-dioxane
Alternate Name(s) [(2S,4S)-2-(4-fluorophenyl)-1,3-dioxan-4-yl]methyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15FO4
InChI InChI=1S/C13H15FO4/c1-9(15)17-8-12-6-7-16-13(18-12)10-2-4-11(14)5-3-10/h2-5,12-13H,6-8H2,1H3/t12-,13-/m0/s1
InChIKey CHPFCYRPYGRWEK-STQMWFEESA-N
Molecular Weight 254.257 g/mol
SMILES [C@@]1(O[C@](COC(=O)C)(CCO1)[H])(c1ccc(cc1)F)[H]
SPLASH splash10-00dl-5910000000-81eeff8191412734b381
Source of Spectrum QC-4-859-5
Wiley ID 883318