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1-(4-Hydroxyphenyl)-9-(3,4-dihydroxyphenyl)-non-3-en-6-yn-5-one
SpectraBase Compound ID 5o6ygzrfvpQ
InChI InChI=1S/C21H20O4/c22-18(7-3-1-5-16-9-12-19(23)13-10-16)8-4-2-6-17-11-14-20(24)21(25)15-17/h3,7,9-15,23-25H,1-2,5-6H2/b7-3+
InChIKey ZQCSBZUEOFBKGN-XVNBXDOJSA-N
Mol Weight 336.39 g/mol
Molecular Formula C21H20O4
Exact Mass 336.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LEoaPidLz5y
Name 1-(4-Hydroxyphenyl)-9-(3,4-dihydroxyphenyl)-non-3-en-6-yn-5-one
Alternate Name(s) (E)-9-(3,4-dihydroxyphenyl)-1-(4-hydroxyphenyl)non-3-en-6-yn-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O4
InChI InChI=1S/C21H20O4/c22-18(7-3-1-5-16-9-12-19(23)13-10-16)8-4-2-6-17-11-14-20(24)21(25)15-17/h3,7,9-15,23-25H,1-2,5-6H2/b7-3+
InChIKey ZQCSBZUEOFBKGN-XVNBXDOJSA-N
Molecular Weight 336.387 g/mol
SMILES Oc1cc(ccc1O)CCC#CC(\C=C\CCc1ccc(cc1)O)=O
SPLASH splash10-0a4i-6900000000-071597a5250eae4d2f5e
Source of Spectrum AT-54-1876-11
Wiley ID 1743457