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4-[2-(Ethoxycarbonyl)ethyl]-5-hydroxy-2-methyl-1,3-dioxane
SpectraBase Compound ID Al7JbdsNOxf
InChI InChI=1S/C10H18O5/c1-3-13-10(12)5-4-9-8(11)6-14-7(2)15-9/h7-9,11H,3-6H2,1-2H3
InChIKey BDVSAJMBLLILQG-UHFFFAOYSA-N
Mol Weight 218.25 g/mol
Molecular Formula C10H18O5
Exact Mass 218.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IoXfuquTqWD
Name 4-[2-(Ethoxycarbonyl)ethyl]-5-hydroxy-2-methyl-1,3-dioxane
Alternate Name(s) (2R,4S,5R)-4-[2-(Ethoxycarbonyl)ethyl]-5-hydroxy-2-methyl-1,3-dioxane ethyl 2,3-dideoxy-4,6-O-ethylidenehexonate
Comments Less than 3 mono-isotopic peaks
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Formula C10H18O5
InChI InChI=1S/C10H18O5/c1-3-13-10(12)5-4-9-8(11)6-14-7(2)15-9/h7-9,11H,3-6H2,1-2H3
InChIKey BDVSAJMBLLILQG-UHFFFAOYSA-N
Molecular Weight 218.249 g/mol
SMILES OC1C(OC(OC1)C)CCC(=O)OCC
SPLASH splash10-014i-0090000000-aa69195d7ccc1b1870ca
Source of Spectrum KC-0-1184-9
Wiley ID 827864