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5-(4-Hydroxybenzyl)-2,2-dimethyl-1,3-dioxane-4,6-dione
SpectraBase Compound ID IB6oS1lgKyD
InChI InChI=1S/C13H14O5/c1-13(2)17-11(15)10(12(16)18-13)7-8-3-5-9(14)6-4-8/h3-6,10,14H,7H2,1-2H3
InChIKey ZDONIIXAFJYJLY-UHFFFAOYSA-N
Mol Weight 250.25 g/mol
Molecular Formula C13H14O5
Exact Mass 250.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L7lQpUVv60D
Name 5-(4-Hydroxybenzyl)-2,2-dimethyl-1,3-dioxane-4,6-dione
Alternate Name(s) 1,3-Dioxane-4,6-dione, 5-(4-hydroxybenzyl)-2,2-dimethyl- 5-(4-hydroxybenzyl)-2,2-dimethyl-1,3-dioxane-4,6-quinone 5-[(4-hydroxyphenyl)methyl]-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS Registry Number 153562-27-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O5
InChI InChI=1S/C13H14O5/c1-13(2)17-11(15)10(12(16)18-13)7-8-3-5-9(14)6-4-8/h3-6,10,14H,7H2,1-2H3
InChIKey ZDONIIXAFJYJLY-UHFFFAOYSA-N
Molecular Weight 250.250 g/mol
SMILES Oc1ccc(cc1)CC1C(OC(OC1=O)(C)C)=O
SPLASH splash10-03dl-4900000000-1b4ecf6a97f2aa46227b
Source of Spectrum AD-0-2532-0
Wiley ID 1424848