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2,2-Dimethyl-5-(phenylmethyl)-5-[(E)-3-phenylprop-2-enyl]-1,3-dioxane-4,6-dione
SpectraBase Compound ID LnhxXQn2b87
InChI InChI=1S/C22H22O4/c1-21(2)25-19(23)22(20(24)26-21,16-18-12-7-4-8-13-18)15-9-14-17-10-5-3-6-11-17/h3-14H,15-16H2,1-2H3/b14-9+
InChIKey XTZMJSJZQNZLQP-NTEUORMPSA-N
Mol Weight 350.41 g/mol
Molecular Formula C22H22O4
Exact Mass 350.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4HD1ASVZn0N
Name 2,2-Dimethyl-5-(phenylmethyl)-5-[(E)-3-phenylprop-2-enyl]-1,3-dioxane-4,6-dione
Alternate Name(s) 5-Benzyl-2,2-dimethyl-5-[(E)-3-phenylprop-2-enyl]-1,3-dioxane-4,6-dione 5-Benzyl-5-[(E)-cinnamyl]-2,2-dimethyl-1,3-dioxane-4,6-dione 5-Benzyl-5-[(E)-cinnamyl]-2,2-dimethyl-1,3-dioxane-4,6-quinone
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Formula C22H22O4
InChI InChI=1S/C22H22O4/c1-21(2)25-19(23)22(20(24)26-21,16-18-12-7-4-8-13-18)15-9-14-17-10-5-3-6-11-17/h3-14H,15-16H2,1-2H3/b14-9+
InChIKey XTZMJSJZQNZLQP-NTEUORMPSA-N
Molecular Weight 350.414 g/mol
SMILES C1(OC(C(C(O1)=O)(C\C=C\c1ccccc1)Cc1ccccc1)=O)(C)C
SPLASH splash10-016r-5900000000-3d21bbd52f10b9780b4d
Source of Spectrum O1-65-1921-3
Wiley ID 1593241