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1-Hydroxy-2-(prop-2-en-1-yloxy)anthracene-9,10-dione
SpectraBase Compound ID AEBkAQiQHg5
InChI InChI=1S/C17H12O4/c1-2-9-21-13-8-7-12-14(17(13)20)16(19)11-6-4-3-5-10(11)15(12)18/h2-8,20H,1,9H2
InChIKey CFGQJMGCSSOFOB-UHFFFAOYSA-N
Mol Weight 280.28 g/mol
Molecular Formula C17H12O4
Exact Mass 280.073559 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1tpELtSu4P3
Name 1-Hydroxy-2-(prop-2-en-1-yloxy)anthracene-9,10-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 280.073558862 u
Formula C17H12O4
InChI InChI=1S/C17H12O4/c1-2-9-21-13-8-7-12-14(17(13)20)16(19)11-6-4-3-5-10(11)15(12)18/h2-8,20H,1,9H2
InChIKey CFGQJMGCSSOFOB-UHFFFAOYSA-N
SMILES C12=C(C(C=3C(C2=O)=CC=CC3)=O)C(=C(C=C1)OCC=C)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.863604