3-[7-(2,4-dihydroxy-6-methyl-benzoyl)oxy-6,8-diketo-7-methyl-isochromen-3-yl]acrylic acid

SpectraBase Compound ID	CIiDPQdVxIZ
InChI	InChI=1S/C21H16O9/c1-10-5-12(22)8-15(23)18(10)20(28)30-21(2)16(24)7-11-6-13(3-4-17(25)26)29-9-14(11)19(21)27/h3-9,22-23H,1-2H3,(H,25,26)/b4-3+
InChIKey	ZJIWQCFXEQSFGR-ONEGZZNKSA-N Google Search
Mol Weight	412.35 g/mol
Molecular Formula	C21H16O9
Exact Mass	412.079432 g/mol

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SpectraBase Spectrum ID	G1qE1bHij34
Name	3-[7-(2,4-dihydroxy-6-methyl-benzoyl)oxy-6,8-diketo-7-methyl-isochromen-3-yl]acrylic acid
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C21H16O9
InChI	InChI=1S/C21H16O9/c1-10-5-12(22)8-15(23)18(10)20(28)30-21(2)16(24)7-11-6-13(3-4-17(25)26)29-9-14(11)19(21)27/h3-9,22-23H,1-2H3,(H,25,26)/b4-3+
InChIKey	ZJIWQCFXEQSFGR-ONEGZZNKSA-N
Literature Reference Author	ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation	UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight	412.353 g/mol
Source File Reference	MHKO27199