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2-isopropyl-1,3-dioxane-5,5-dicarboxylic acid diethyl ester
SpectraBase Compound ID 7ZWcEl1QGJ
InChI InChI=1S/C13H22O6/c1-5-16-11(14)13(12(15)17-6-2)7-18-10(9(3)4)19-8-13/h9-10H,5-8H2,1-4H3
InChIKey IELCLUJNTNQUEW-UHFFFAOYSA-N
Mol Weight 274.31 g/mol
Molecular Formula C13H22O6
Exact Mass 274.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BrUwPFalnSF
Name 2-isopropyl-1,3-dioxane-5,5-dicarboxylic acid diethyl ester
Alternate Name(s) 2-Propan-2-yl-1,3-dioxane-5,5-dicarboxylic acid diethyl ester Diethyl 2-isopropyl-1,3-dioxane-5,5-dicarboxylate Diethyl 2-propan-2-yl-1,3-dioxane-5,5-dicarboxylate
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Formula C13H22O6
InChI InChI=1S/C13H22O6/c1-5-16-11(14)13(12(15)17-6-2)7-18-10(9(3)4)19-8-13/h9-10H,5-8H2,1-4H3
InChIKey IELCLUJNTNQUEW-UHFFFAOYSA-N
Molecular Weight 274.313 g/mol
SMILES C1(C(=O)OCC)(C(=O)OCC)COC(OC1)C(C)C
SPLASH splash10-0a7i-9750000000-74150cfe50d4bbcb3521
Source of Spectrum O-26-650-1
Wiley ID 1277858