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2,7-Diphenyl-3H-azepine

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

2,7-Diphenyl-3H-azepine
SpectraBase Compound ID AxfHyZ7b4BW
InChI InChI=1S/C18H15N/c1-3-9-15(10-4-1)17-13-7-8-14-18(19-17)16-11-5-2-6-12-16/h1-13H,14H2
InChIKey FMWXMSKRJIIWLA-UHFFFAOYSA-N
Mol Weight 245.32 g/mol
Molecular Formula C18H15N
Exact Mass 245.120449 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AKFM0LgfNGR
Name 2,7-Diphenyl-3H-azepine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 245.120449487 u
Formula C18H15N
InChI InChI=1S/C18H15N/c1-3-9-15(10-4-1)17-13-7-8-14-18(19-17)16-11-5-2-6-12-16/h1-13H,14H2
InChIKey FMWXMSKRJIIWLA-UHFFFAOYSA-N
Molecular Weight 245.325 g/mol
SMILES C=1(N=C(CC=CC1)C=1C=CC=CC1)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.963759