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2-HYDROTRIOXY-2-PHENYL-5,5-DIMETHYL-1,3-DIOXANE

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2-HYDROTRIOXY-2-PHENYL-5,5-DIMETHYL-1,3-DIOXANE
SpectraBase Compound ID 35cuwCPxSwa
InChI InChI=1S/C12H16O5/c1-11(2)8-14-12(15-9-11,16-17-13)10-6-4-3-5-7-10/h3-7,13H,8-9H2,1-2H3
InChIKey AZDGRZYQPSAYSS-UHFFFAOYSA-N
Mol Weight 240.25 g/mol
Molecular Formula C12H16O5
Exact Mass 240.099774 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9nWKiI2OQVE
Name 2-HYDROTRIOXY-2-PHENYL-5,5-DIMETHYL-1,3-DIOXANE
Compound Number 3H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16O5
InChI InChI=1S/C12H16O5/c1-11(2)8-14-12(15-9-11,16-17-13)10-6-4-3-5-7-10/h3-7,13H,8-9H2,1-2H3
InChIKey AZDGRZYQPSAYSS-UHFFFAOYSA-N
Literature Reference Author T.TUTTLE,J.CERKOVNIK,B.PLESNICAR,D.CREMER
Literature Reference Citation J.AM.CHEM.SOC.,126,16093(2004)
Literature Reference DOI 10.1021/ja0450511
Solvent ACETONE-D6
Source File Reference UWVN32167