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5-Amino-5-phenyl-5H-dibenzo[a,d]cycloheptene

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

5-Amino-5-phenyl-5H-dibenzo[a,d]cycloheptene
SpectraBase Compound ID CWDZGsYMNsh
InChI InChI=1S/C21H17N/c22-21(18-10-2-1-3-11-18)19-12-6-4-8-16(19)14-15-17-9-5-7-13-20(17)21/h1-15H,22H2
InChIKey TYIIEPQDAGJRNV-UHFFFAOYSA-N
Mol Weight 283.37 g/mol
Molecular Formula C21H17N
Exact Mass 283.1361 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IpOO6OOfL15
Name 5-Amino-5-phenyl-5H-dibenzo[A,D]cycloheptene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 283.136099551 u
Formula C21H17N
InChI InChI=1S/C21H17N/c22-21(18-10-2-1-3-11-18)19-12-6-4-8-16(19)14-15-17-9-5-7-13-20(17)21/h1-15H,22H2
InChIKey TYIIEPQDAGJRNV-UHFFFAOYSA-N
Molecular Weight 283.374 g/mol
SMILES C1(N)(C2=CC=CC=C2)C2=CC=CC=C2C=CC2=CC=CC=C12
Spectrum/Structure Validation Score (Vapor Phase IR) 0.986151