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3-(3,5-dibromo-4-methoxyphenyl)-1-phenylprop-2-en-1-one
SpectraBase Compound ID HhEQ3oHiXFo
InChI InChI=1S/C16H12Br2O2/c1-20-16-13(17)9-11(10-14(16)18)7-8-15(19)12-5-3-2-4-6-12/h2-10H,1H3/b8-7+
InChIKey VGUSHKSUMZLKMW-BQYQJAHWSA-N
Mol Weight 396.08 g/mol
Molecular Formula C16H12Br2O2
Exact Mass 393.920406 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BorwMcyaQGA
Name 3-(3,5-dibromo-4-methoxyphenyl)-1-phenylprop-2-en-1-one
Appearance Colorless crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12Br2O2
InChI InChI=1S/C16H12Br2O2/c1-20-16-13(17)9-11(10-14(16)18)7-8-15(19)12-5-3-2-4-6-12/h2-10H,1H3/b8-7+
InChIKey VGUSHKSUMZLKMW-BQYQJAHWSA-N
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3444
Molecular Weight 396.078 g/mol
SMILES c1cc(ccc1)C(\C=C\c1cc(c(c(c1)Br)OC)Br)=O
SPLASH splash10-004i-9003000000-fb85cc17ae4734b99e0b
Source of Spectrum Y-56-657-3
Wiley ID 1859441