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2,3,5-triacetoxy-8-hydroxy-1,4-naphthoquinone
SpectraBase Compound ID 7KYexhKTUTq
InChI InChI=1S/C16H12O9/c1-6(17)23-10-5-4-9(20)11-12(10)14(22)16(25-8(3)19)15(13(11)21)24-7(2)18/h4-5,20H,1-3H3
InChIKey UKJKUKQKXIBOAG-UHFFFAOYSA-N
Mol Weight 348.26 g/mol
Molecular Formula C16H12O9
Exact Mass 348.048132 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1RrlPRTGv8S
Name 2,3,5-triacetoxy-8-hydroxy-1,4-naphthoquinone
Comments Less than 3 mono-isotopic peaks
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Formula C16H12O9
InChI InChI=1S/C16H12O9/c1-6(17)23-10-5-4-9(20)11-12(10)14(22)16(25-8(3)19)15(13(11)21)24-7(2)18/h4-5,20H,1-3H3
InChIKey UKJKUKQKXIBOAG-UHFFFAOYSA-N
Molecular Weight 348.263 g/mol
SMILES Oc1ccc(c2C(C(=C(C(c12)=O)OC(=O)C)OC(=O)C)=O)OC(=O)C
SPLASH splash10-00di-0390000000-2a1fe484cb1ce2ae8326
Source of Spectrum B-52-1176-15
Synonyms 3,5-bis(acetyloxy)-8-hydroxy-1,4-dioxo-1,4-dihydro-2-naphthalenyl acetate
Wiley ID 746805