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2-Butanoyl-3,6,8-trihydroxy-1,4-naphthoquinone
SpectraBase Compound ID FXk85Z3bdjx
InChI InChI=1S/C14H12O6/c1-2-3-8(16)11-13(19)10-7(12(18)14(11)20)4-6(15)5-9(10)17/h4-5,15,17,20H,2-3H2,1H3
InChIKey JRRIGBUEMIKNFG-UHFFFAOYSA-N
Mol Weight 276.24 g/mol
Molecular Formula C14H12O6
Exact Mass 276.063388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7gn91jsCHK
Name 2-Butanoyl-3,6,8-trihydroxy-1,4-naphthoquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12O6
InChI InChI=1S/C14H12O6/c1-2-3-8(16)11-13(19)10-7(12(18)14(11)20)4-6(15)5-9(10)17/h4-5,15,17,20H,2-3H2,1H3
InChIKey JRRIGBUEMIKNFG-UHFFFAOYSA-N
Molecular Weight 276.244 g/mol
SMILES Oc1c2C(C(=C(C(c2cc(c1)O)=O)O)C(CCC)=O)=O
SPLASH splash10-08i0-4090000000-12ffa180ad794a331a6c
Source of Spectrum E2-50-1612-4
Synonyms 3-Butyryl-2,5,7-trihydroxynaphthoquinone
Wiley ID 1555999