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5-(4-Hydroxybenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione
SpectraBase Compound ID AE8K5UoFpbg
InChI InChI=1S/C13H12O5/c1-13(2)17-11(15)10(12(16)18-13)7-8-3-5-9(14)6-4-8/h3-7,14H,1-2H3
InChIKey JPPNMIXVIYOENU-UHFFFAOYSA-N
Mol Weight 248.23 g/mol
Molecular Formula C13H12O5
Exact Mass 248.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8QeWwbChDsp
Name 5-(4-Hydroxybenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS Registry Number 17474-27-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12O5
InChI InChI=1S/C13H12O5/c1-13(2)17-11(15)10(12(16)18-13)7-8-3-5-9(14)6-4-8/h3-7,14H,1-2H3
InChIKey JPPNMIXVIYOENU-UHFFFAOYSA-N
Molecular Weight 248.234 g/mol
SMILES Oc1ccc(cc1)C=C1C(=O)OC(C)(OC1=O)C
SPLASH splash10-0007-4900000000-832673a1aa8d09419ce8
Source of Spectrum HE-1982-0-0
Synonyms 5-(4-hydroxybenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-quinone 5-[(4-hydroxyphenyl)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione 5-[(4-hydroxyphenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Malonic acid, (p-hydroxybenzylidene)-, cyclic isopropylidene ester
Wiley ID 1250858