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Rel-2S,4S,6S-2,6-dimethyl-4-(N'-methyl-N'-phenyl-thioureido)-1,3-dioxane

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Rel-2S,4S,6S-2,6-dimethyl-4-(N'-methyl-N'-phenyl-thioureido)-1,3-dioxane
SpectraBase Compound ID Df3DKHsVBka
InChI InChI=1S/C14H20N2O2S/c1-10-9-13(18-11(2)17-10)15-14(19)16(3)12-7-5-4-6-8-12/h4-8,10-11,13H,9H2,1-3H3,(H,15,19)
InChIKey GFMGKZFUCVFYIQ-UHFFFAOYSA-N
Mol Weight 280.39 g/mol
Molecular Formula C14H20N2O2S
Exact Mass 280.124549 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5EDhE0lBv5q
Name Rel-2S,4S,6S-2,6-dimethyl-4-(N'-methyl-N'-phenyl-thioureido)-1,3-dioxane
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Formula C14H20N2O2S
InChI InChI=1S/C14H20N2O2S/c1-10-9-13(18-11(2)17-10)15-14(19)16(3)12-7-5-4-6-8-12/h4-8,10-11,13H,9H2,1-3H3,(H,15,19)
InChIKey GFMGKZFUCVFYIQ-UHFFFAOYSA-N
Literature Reference J. Bernat, L. Kniezo, G. Birosova, Tetrahedron 47, 4665 (1991).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3