(1R,3R,4S)-1,3-dimethyl-4,7,9-tris(oxidanyl)-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione

SpectraBase Compound ID	KCpPDTYEVsQ
InChI	InChI=1S/C15H14O6/c1-5-10-12(13(18)6(2)21-5)14(19)8-3-7(16)4-9(17)11(8)15(10)20/h3-6,13,16-18H,1-2H3/t5-,6-,13-/m1/s1
InChIKey	LJEROUHPDCFEGJ-VVTLTYDVSA-N Google Search
Mol Weight	290.27 g/mol
Molecular Formula	C15H14O6
Exact Mass	290.079038 g/mol

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SpectraBase Spectrum ID	4I8ynytji07
Name	(1R,3R,4S)-1,3-dimethyl-4,7,9-tris(oxidanyl)-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione
CAS Registry Number	119182-21-7
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C15H14O6
InChI	InChI=1S/C15H14O6/c1-5-10-12(13(18)6(2)21-5)14(19)8-3-7(16)4-9(17)11(8)15(10)20/h3-6,13,16-18H,1-2H3/t5-,6-,13-/m1/s1
InChIKey	LJEROUHPDCFEGJ-VVTLTYDVSA-N
Molecular Weight	290.271 g/mol
SMILES	Oc1cc2C(C3=C(C(c2c(c1)O)=O)[C@](O[C@@]([C@]3(O)[H])(C)[H])(C)[H])=O
SPLASH	splash10-014i-0090000000-f25ea3a53a5bd42d0364
Source of Spectrum	KC-1988-2475-1
Synonyms	(1R,3R,4S)-4,7,9-trihydroxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione (1R,3R,4S)-4,7,9-trihydroxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g][2]benzopyran-5,10-dione (1R,3R,4S)-4,7,9-trihydroxy-1,3-dimethyl-3,4-dihydro-1H-benz[g]isochromene-5,10-quinone
Wiley ID	1293405