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8-Hydroxy-2-(2',3',5',6',7',7'a-7'a-hydroxy-2-oxobenzofuran-4'-yl)-1,4-naphthoquinone
SpectraBase Compound ID 4e5F60ygbhv
InChI InChI=1S/C18H14O6/c19-13-5-1-3-10-14(20)7-11(17(22)16(10)13)9-4-2-6-18(23)12(9)8-15(21)24-18/h1,3,5,7-9,19,23H,2,4,6H2/t9-,18-/m1/s1
InChIKey GUKXCLMUYJQTED-DYBLOJMWSA-N
Mol Weight 326.3 g/mol
Molecular Formula C18H14O6
Exact Mass 326.079038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rqgzOobTTf
Name 8-Hydroxy-2-(2',3',5',6',7',7'a-7'a-hydroxy-2-oxobenzofuran-4'-yl)-1,4-naphthoquinone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14O6
InChI InChI=1S/C18H14O6/c19-13-5-1-3-10-14(20)7-11(17(22)16(10)13)9-4-2-6-18(23)12(9)8-15(21)24-18/h1,3,5,7-9,19,23H,2,4,6H2/t9-,18-/m1/s1
InChIKey GUKXCLMUYJQTED-DYBLOJMWSA-N
Molecular Weight 326.304 g/mol
SMILES Oc1cccc2c1C(C([C@@]1(C=3[C@@](CCC1)(OC(C3)=O)O)[H])=CC2=O)=O
SPLASH splash10-001i-0093000000-257e9a84c7153b8d4600
Source of Spectrum U-1994-475-12
Synonyms 8-Hydroxy-2-((4S,7aR)-7a-hydroxy-2-oxo-2,4,5,6,7,7a-hexahydro-benzofuran-4-yl)-[1,4]naphthoquinone 8-Hydroxy-2-(2,4,5,6,7,7a-hexahydro-7a-hydroxy-2-oxobenzofuran-4-yl)-1,4-naphthoquinone
Wiley ID 765805