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Dibenzo[b,h]biphenylene-5,12-dione, 5a,11b-dihydro-6,11-dihydroxy-
SpectraBase Compound ID YVgiLgsXXy
InChI InChI=1S/C20H12O4/c21-17-9-5-1-2-6-10(9)18(22)14-13(17)15-16(14)20(24)12-8-4-3-7-11(12)19(15)23/h1-8,13-14,23-24H
InChIKey MVGCIFXFMUMGSO-UHFFFAOYSA-N
Mol Weight 316.31 g/mol
Molecular Formula C20H12O4
Exact Mass 316.073559 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 77EtNAIEkNL
Name Dibenzo[B,H]biphenylene-5,12-dione, 5A,11B-dihydro-6,11-dihydroxy-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 316.073558862 u
Formula C20H12O4
InChI InChI=1S/C20H12O4/c21-17-9-5-1-2-6-10(9)18(22)14-13(17)15-16(14)20(24)12-8-4-3-7-11(12)19(15)23/h1-8,13-14,23-24H
InChIKey MVGCIFXFMUMGSO-UHFFFAOYSA-N
Molecular Weight 316.312 g/mol
SMILES C1(=O)C2C3=C(C2C(C2=C1C=CC=C2)=O)C(O)=C1C(=C3O)C=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.829953