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7-Phenyl-2,3:4,5-dibenzonorcaradiene

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

7-Phenyl-2,3:4,5-dibenzonorcaradiene
SpectraBase Compound ID B8LC7g6ZS5F
InChI InChI=1S/C21H16/c1-2-6-14(7-3-1)15-10-11-18-19(12-15)16-8-4-5-9-17(16)20-13-21(18)20/h1-11,21H,12-13H2
InChIKey IDSVHKMPTAUZCL-UHFFFAOYSA-N
Mol Weight 268.36 g/mol
Molecular Formula C21H16
Exact Mass 268.125201 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID K9A5evTeyA4
Name 7-Phenyl-2,3:4,5-dibenzonorcaradiene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.125200515 u
Formula C21H16
InChI InChI=1S/C21H16/c1-2-6-14(7-3-1)15-10-11-18-19(12-15)16-8-4-5-9-17(16)20-13-21(18)20/h1-11,21H,12-13H2
InChIKey IDSVHKMPTAUZCL-UHFFFAOYSA-N
SMILES C1=2C(C3=CC=C(CC3=C3C2C=CC=C3)C=2C=CC=CC2)C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.920631