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(4S,5S)-5-Methoxy-2,2-dimethyl-4-phenyl-1,3-dioxane
SpectraBase Compound ID C7MiGVGNLjw
InChI InChI=1S/C13H18O3/c1-13(2)15-9-11(14-3)12(16-13)10-7-5-4-6-8-10/h4-8,11-12H,9H2,1-3H3/t11-,12-/m0/s1
InChIKey JWASIGNBKGYVJQ-RYUDHWBXSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8iUYYaTnlii
Name (4S,5S)-5-Methoxy-2,2-dimethyl-4-phenyl-1,3-dioxane
Comments Removed - expert review: contamination (acetone))
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Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-13(2)15-9-11(14-3)12(16-13)10-7-5-4-6-8-10/h4-8,11-12H,9H2,1-3H3/t11-,12-/m0/s1
InChIKey JWASIGNBKGYVJQ-RYUDHWBXSA-N
Molecular Weight 222.284 g/mol
SMILES [C@@]1(OC(OC[C@@]1(OC)[H])(C)C)(c1ccccc1)[H]
SPLASH splash10-0a4i-9000000000-da5bb37d6a759a41d948
Source of Spectrum KC-0-1015-24
Wiley ID 783663