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Benzo[a]naphthacene-8,13-dione

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

Benzo[a]naphthacene-8,13-dione
SpectraBase Compound ID G8OHTfe8pWz
InChI InChI=1S/C22H12O2/c23-21-16-7-3-4-8-17(16)22(24)20-12-18-14(11-19(20)21)10-9-13-5-1-2-6-15(13)18/h1-12H
InChIKey ZSJHQAXALDPPRW-UHFFFAOYSA-N
Mol Weight 308.34 g/mol
Molecular Formula C22H12O2
Exact Mass 308.08373 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B6xRx8QbVs4
Name Benzo[A]naphthacene-8,13-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 308.083729624 u
Formula C22H12O2
InChI InChI=1S/C22H12O2/c23-21-16-7-3-4-8-17(16)22(24)20-12-18-14(11-19(20)21)10-9-13-5-1-2-6-15(13)18/h1-12H
InChIKey ZSJHQAXALDPPRW-UHFFFAOYSA-N
Molecular Weight 308.336 g/mol
SMILES C1(=O)C2=CC3=C4C(=CC=C3C=C2C(C2=C1C=CC=C2)=O)C=CC=C4
Spectrum/Structure Validation Score (Vapor Phase IR) 0.927628