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6-Bromo-9-acetylphenanthrene

View entire compound with spectra: 1 FTIR

6-Bromo-9-acetylphenanthrene
SpectraBase Compound ID HJxEjOLbuG0
InChI InChI=1S/C16H11BrO/c1-10(18)15-8-11-4-2-3-5-13(11)16-9-12(17)6-7-14(15)16/h2-9H,1H3
InChIKey AZXFCQJWAAKUBY-UHFFFAOYSA-N
Mol Weight 299.17 g/mol
Molecular Formula C16H11BrO
Exact Mass 297.999328 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1DeIM4n1O76
Name 6-Bromo-9-acetylphenanthrene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 297.999327973 u
Formula C16H11BrO
InChI InChI=1S/C16H11BrO/c1-10(18)15-8-11-4-2-3-5-13(11)16-9-12(17)6-7-14(15)16/h2-9H,1H3
InChIKey AZXFCQJWAAKUBY-UHFFFAOYSA-N
Molecular Weight 299.167 g/mol
SMILES CC(=O)C=1C=C2C(=C3C1C=CC(Br)=C3)C=CC=C2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.904176