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6,13-Dihydro-6,13-ethanopentacen-15-one

View entire compound with spectra: 1 FTIR

6,13-Dihydro-6,13-ethanopentacen-15-one
SpectraBase Compound ID 7jID3wuxtD0
InChI InChI=1S/C24H16O/c25-23-13-20-18-9-14-5-1-3-7-16(14)11-21(18)24(23)22-12-17-8-4-2-6-15(17)10-19(20)22/h1-12,20,24H,13H2/t20-,24+
InChIKey ZPTLUISJVPFJQB-RZJSWYKGSA-N
Mol Weight 320.39 g/mol
Molecular Formula C24H16O
Exact Mass 320.120115 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2LnXWPHfC3F
Name 6,13-Dihydro-6,13-ethanopentacen-15-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.120115134 u
Formula C24H16O
InChI InChI=1S/C24H16O/c25-23-13-20-18-9-14-5-1-3-7-16(14)11-21(18)24(23)22-12-17-8-4-2-6-15(17)10-19(20)22/h1-12,20,24H,13H2/t20-,24+
InChIKey ZPTLUISJVPFJQB-RZJSWYKGSA-N
Molecular Weight 320.391 g/mol
SMILES C12=C(C=C3C(=C2)C=CC=C3)[C@]2(C3=CC4=CC=CC=C4C=C3[C@@]1(C(C2)=O)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.888935