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10-Bromo-3-methyl-9-phenylphenanthrene

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

10-Bromo-3-methyl-9-phenylphenanthrene
SpectraBase Compound ID 541BWDpMgPM
InChI InChI=1S/C21H15Br/c1-14-11-12-18-19(13-14)16-9-5-6-10-17(16)20(21(18)22)15-7-3-2-4-8-15/h2-13H,1H3
InChIKey QGQWIVDCAKUQIB-UHFFFAOYSA-N
Mol Weight 347.26 g/mol
Molecular Formula C21H15Br
Exact Mass 346.035713 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ecLt7k35Mp
Name 10-Bromo-3-methyl-9-phenylphenanthrene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 346.035713483 u
Formula C21H15Br
InChI InChI=1S/C21H15Br/c1-14-11-12-18-19(13-14)16-9-5-6-10-17(16)20(21(18)22)15-7-3-2-4-8-15/h2-13H,1H3
InChIKey QGQWIVDCAKUQIB-UHFFFAOYSA-N
Molecular Weight 347.255 g/mol
SMILES C1(=C(C2=CC=CC=C2C=2C1=CC=C(C)C2)C1=CC=CC=C1)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.818884