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2-Bromo-2-(phenylethynyl)naphthalene

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

2-Bromo-2-(phenylethynyl)naphthalene
SpectraBase Compound ID wiMHMBZJvv
InChI InChI=1S/C18H11Br/c19-18-16(11-10-14-6-2-1-3-7-14)13-12-15-8-4-5-9-17(15)18/h1-9,12-13H
InChIKey JZKISOGSQZTPIY-UHFFFAOYSA-N
Mol Weight 307.19 g/mol
Molecular Formula C18H11Br
Exact Mass 306.004413 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AJk2VLfIpkq
Name 2-Bromo-2-(phenylethynyl)naphthalene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 306.004413354 u
Formula C18H11Br
InChI InChI=1S/C18H11Br/c19-18-16(11-10-14-6-2-1-3-7-14)13-12-15-8-4-5-9-17(15)18/h1-9,12-13H
InChIKey JZKISOGSQZTPIY-UHFFFAOYSA-N
Molecular Weight 307.190 g/mol
SMILES C(#CC1=CC=CC=C1)C1=C(C2=CC=CC=C2C=C1)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.899907