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5-Acetoxy-2,2-dimethyl-4-(2-benzyloxy-1-formyloxyethyl)[1,3]-dioxaolane
SpectraBase Compound ID DC9OuQCCsI0
InChI InChI=1S/C17H20O8/c1-11(19)23-16-14(24-17(2,3)25-16)13(22-10-18)9-21-15(20)12-7-5-4-6-8-12/h4-8,10,13-14,16H,9H2,1-3H3/t13-,14+,16+/m0/s1
InChIKey CQDXJUMCCFDHIG-SQWLQELKSA-N
Mol Weight 352.34 g/mol
Molecular Formula C17H20O8
Exact Mass 352.115818 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jZ2he7aKjl
Name 5-Acetoxy-2,2-dimethyl-4-(2-benzyloxy-1-formyloxyethyl)[1,3]-dioxaolane
Alternate Name(s) 5-Acetoxy-2,2-dimethyl-4-(2-benzyloxy-1-formyloxyethyl)[1,3]-dioxaolane isomer 5-Acetoxy-2,2-dimethyl-4-(2-benzoyloxy-1-formyloxyethyl)[1,3]-dioxaolane isomer Benzoic acid (S)-2-((4R,5S)-5-acetoxy-2,2-dimethyl-[1,3]dioxolan-4-yl)-2-formyloxy-ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C17H20O8
InChI InChI=1S/C17H20O8/c1-11(19)23-16-14(24-17(2,3)25-16)13(22-10-18)9-21-15(20)12-7-5-4-6-8-12/h4-8,10,13-14,16H,9H2,1-3H3/t13-,14+,16+/m0/s1
InChIKey CQDXJUMCCFDHIG-SQWLQELKSA-N
Molecular Weight 352.339 g/mol
SMILES [C@]1([C@](OC(O1)(C)C)([C@](COC(=O)c1ccccc1)(OC=O)[H])[H])(OC(=O)C)[H]
SPLASH splash10-0a4i-0903000000-59a7479cb20ab62b91a6
Source of Spectrum AT-42-9170-9
Wiley ID 855313