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9H-8-Oxa-1,3a-diazabenzo[6,7]cyclohepta[1,2,3-jk]fluorene

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

9H-8-Oxa-1,3a-diazabenzo[6,7]cyclohepta[1,2,3-jk]fluorene
SpectraBase Compound ID KHSX8LHoT2u
InChI InChI=1S/C18H12N2O/c1-2-6-13-12(5-1)14-11-21-16-8-4-3-7-15(16)20-10-9-19-17(13)18(14)20/h1-10H,11H2
InChIKey ZPBZIJUAIRSEKJ-UHFFFAOYSA-N
Mol Weight 272.31 g/mol
Molecular Formula C18H12N2O
Exact Mass 272.094963 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BUcoOgrjPNy
Name 9H-8-oxa-1,3A-Diazabenzo[6,7]cyclohepta[1,2,3-jk]fluorene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 272.094963013 u
Formula C18H12N2O
InChI InChI=1S/C18H12N2O/c1-2-6-13-12(5-1)14-11-21-16-8-4-3-7-15(16)20-10-9-19-17(13)18(14)20/h1-10H,11H2
InChIKey ZPBZIJUAIRSEKJ-UHFFFAOYSA-N
Molecular Weight 272.307 g/mol
SMILES C12=C3C=4C=CC=CC4C2=NC=CN1C=1C(=CC=CC1)OC3
Spectrum/Structure Validation Score (Vapor Phase IR) 0.906274