For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Benzo[3,4]cyclobuta[1,2-b]anthraquinone

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

Benzo[3,4]cyclobuta[1,2-b]anthraquinone
SpectraBase Compound ID 8ujN53iQagU
InChI InChI=1S/C20H10O2/c21-19-14-7-3-4-8-15(14)20(22)18-16(19)10-9-13-11-5-1-2-6-12(11)17(13)18/h1-10H
InChIKey YLBZVLHSAWGEER-UHFFFAOYSA-N
Mol Weight 282.3 g/mol
Molecular Formula C20H10O2
Exact Mass 282.06808 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BqG3GU7ztTX
Name Benzo[3,4]cyclobuta[1,2-B]anthraquinone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 282.068079560 u
Formula C20H10O2
InChI InChI=1S/C20H10O2/c21-19-14-7-3-4-8-15(14)20(22)18-16(19)10-9-13-11-5-1-2-6-12(11)17(13)18/h1-10H
InChIKey YLBZVLHSAWGEER-UHFFFAOYSA-N
SMILES C1=2C3=C(C=CC2C(C=2C=CC=CC2C1=O)=O)C1=C3C=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.896684