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1-Anilino-3-phenyl-1-azaazulen-2(1H)-one

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

1-Anilino-3-phenyl-1-azaazulen-2(1H)-one
SpectraBase Compound ID 35xWTBKJAJs
InChI InChI=1S/C21H16N2O/c24-21-20(16-10-4-1-5-11-16)18-14-8-3-9-15-19(18)23(21)22-17-12-6-2-7-13-17/h1-15,22H
InChIKey IUWQWNNECGCESR-UHFFFAOYSA-N
Mol Weight 312.37 g/mol
Molecular Formula C21H16N2O
Exact Mass 312.126263 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5d6rZH7bF8G
Name 1-Anilino-3-phenyl-1-azaazulen-2(1H)-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 312.126263142 u
Formula C21H16N2O
InChI InChI=1S/C21H16N2O/c24-21-20(16-10-4-1-5-11-16)18-14-8-3-9-15-19(18)23(21)22-17-12-6-2-7-13-17/h1-15,22H
InChIKey IUWQWNNECGCESR-UHFFFAOYSA-N
SMILES C1(N(C=2C(=C1C=1C=CC=CC1)C=CC=CC2)NC=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.950313