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(S,S)-4-(Acetoxymethyl)-2(4-metoxy-phenyl)-1,3-dioxane

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(S,S)-4-(Acetoxymethyl)-2(4-metoxy-phenyl)-1,3-dioxane
SpectraBase Compound ID 9IdQkExlnG9
InChI InChI=1S/C14H18O5/c1-10(15)18-9-13-7-8-17-14(19-13)11-3-5-12(16-2)6-4-11/h3-6,13-14H,7-9H2,1-2H3/t13-,14-/m1/s1
InChIKey ASFUIDHDVWMFQP-ZIAGYGMSSA-N
Mol Weight 266.29 g/mol
Molecular Formula C14H18O5
Exact Mass 266.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GWfnAp8uqL4
Name (S,S)-4-(Acetoxymethyl)-2(4-metoxy-phenyl)-1,3-dioxane
Comments Computed using HOSE algorithm
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Exact Mass 266.115423675 u
Formula C14H18O5
InChI InChI=1S/C14H18O5/c1-10(15)18-9-13-7-8-17-14(19-13)11-3-5-12(16-2)6-4-11/h3-6,13-14H,7-9H2,1-2H3/t13-,14-/m1/s1
InChIKey ASFUIDHDVWMFQP-ZIAGYGMSSA-N
Molecular Weight 266.293 g/mol
SMILES [C@]1(O[C@@](COC(=O)C)(CCO1)[H])(C1=CC=C(C=C1)OC)[H]