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(E)-1-(2,4-Dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one, triacetate
SpectraBase Compound ID FOEOgi644w9
InChI InChI=1S/C21H18O7/c1-13(22)26-17-7-4-16(5-8-17)6-11-20(25)19-10-9-18(27-14(2)23)12-21(19)28-15(3)24/h4-12H,1-3H3/b11-6+
InChIKey SLOPRAJOFODBEQ-IZZDOVSWSA-N
Mol Weight 382.37 g/mol
Molecular Formula C21H18O7
Exact Mass 382.105253 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7f80VHbUBYw
Name (E)-1-(2,4-Dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one, triacetate
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 382.105252913 u
Formula C21H18O7
InChI InChI=1S/C21H18O7/c1-13(22)26-17-7-4-16(5-8-17)6-11-20(25)19-10-9-18(27-14(2)23)12-21(19)28-15(3)24/h4-12H,1-3H3/b11-6+
InChIKey SLOPRAJOFODBEQ-IZZDOVSWSA-N
Molecular Weight 382.368 g/mol
SMILES C1=C(C=CC(=C1)\C=C\C(C1=CC=C(C=C1OC(=O)C)OC(=O)C)=O)OC(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.885149