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2-Hydroxy-3-(4-methoxyphenyl)naphthalene-1,4-dione
SpectraBase Compound ID LFhrw1lPUt6
InChI InChI=1S/C17H12O4/c1-21-11-8-6-10(7-9-11)14-15(18)12-4-2-3-5-13(12)16(19)17(14)20/h2-9,20H,1H3
InChIKey LLMWUKJCIBAIJZ-UHFFFAOYSA-N
Mol Weight 280.28 g/mol
Molecular Formula C17H12O4
Exact Mass 280.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5kbhedDxKx
Name 2-Hydroxy-3-(4-methoxyphenyl)naphthalene-1,4-dione
Appearance Red solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12O4
InChI InChI=1S/C17H12O4/c1-21-11-8-6-10(7-9-11)14-15(18)12-4-2-3-5-13(12)16(19)17(14)20/h2-9,20H,1H3
InChIKey LLMWUKJCIBAIJZ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/ml300242v
Molecular Weight 280.279 g/mol
SMILES OC=1C(c2c(C(C1c1ccc(cc1)OC)=O)cccc2)=O
SPLASH splash10-001i-0190000000-ce6732fd239993f83725
Source of Spectrum MCS-3-SM8-38
Thin-Layer Chromatography Rf = 0.22 (hexanes/EtOAc, 7:1)
Wiley ID 1864073