8-[(p-Methoxybenzyl)oxy]-1,1-dibromoocta-1,3-diene

SpectraBase Compound ID	8BhwDAJTtKN
InChI	InChI=1S/C16H20Br2O2/c1-19-15-10-8-14(9-11-15)13-20-12-6-4-2-3-5-7-16(17)18/h3,5,7-11H,2,4,6,12-13H2,1H3/b5-3+
InChIKey	XYIJOLHLQPARIU-HWKANZROSA-N Google Search
Mol Weight	404.14 g/mol
Molecular Formula	C16H20Br2O2
Exact Mass	401.983006 g/mol

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SpectraBase Spectrum ID	KImR6DUFhHW
Name	8-[(p-Methoxybenzyl)oxy]-1,1-dibromoocta-1,3-diene
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	401.983005882 u
Formula	C16H20Br2O2
InChI	InChI=1S/C16H20Br2O2/c1-19-15-10-8-14(9-11-15)13-20-12-6-4-2-3-5-7-16(17)18/h3,5,7-11H,2,4,6,12-13H2,1H3/b5-3+
InChIKey	XYIJOLHLQPARIU-HWKANZROSA-N
Molecular Weight	404.142 g/mol
SMILES	C(=C\C=C\CCCCOCC=1C=CC(=CC1)OC)(Br)Br
Spectrum/Structure Validation Score (Vapor Phase IR)	0.919957