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2-((4-bromo-2-methylphenyl)ethynyl)benzaldehyde
SpectraBase Compound ID 5nE53cEpjEj
InChI InChI=1S/C16H11BrO/c1-12-10-16(17)9-8-13(12)6-7-14-4-2-3-5-15(14)11-18/h2-5,8-11H,1H3
InChIKey MYSYZBFHWQEWAV-UHFFFAOYSA-N
Mol Weight 299.17 g/mol
Molecular Formula C16H11BrO
Exact Mass 297.999328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C6ykNBPBFVm
Name 2-((4-bromo-2-methylphenyl)ethynyl)benzaldehyde
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 297.999327973 u
Formula C16H11BrO
InChI InChI=1S/C16H11BrO/c1-12-10-16(17)9-8-13(12)6-7-14-4-2-3-5-15(14)11-18/h2-5,8-11H,1H3
InChIKey MYSYZBFHWQEWAV-UHFFFAOYSA-N
Instrument Name JEOL JMD-700
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.201501725
Molecular Weight 299.167 g/mol
Quality 180
Reported Formula C16H11(79)BrO
SMILES C1(Br)=CC(=C(C=C1)C#CC1=C(C=CC=C1)C=O)C
SPLASH splash10-0gbm-0592000000-b2a088e9f24190189b74
Source of Spectrum QE-21-SM9-Ik (DOI: 10.1002/chem.201501725)
Thin-Layer Chromatography 0.70 (PE/EA, 10:1)
Wiley ID 1907141