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3-(2-Bromophenyl)-6-chloro-7-methyl-4H-chromen-4-one
SpectraBase Compound ID Ffvf3TorArm
InChI InChI=1S/C16H10BrClO2/c1-9-6-15-11(7-14(9)18)16(19)12(8-20-15)10-4-2-3-5-13(10)17/h2-8H,1H3
InChIKey KOUCLASGGOOWBJ-UHFFFAOYSA-N
Mol Weight 349.61 g/mol
Molecular Formula C16H10BrClO2
Exact Mass 347.95527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dpd2h4nOiLT
Name 3-(2-Bromophenyl)-6-chloro-7-methyl-4H-chromen-4-one
Appearance Light brown solid
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Formula C16H10BrClO2
InChI InChI=1S/C16H10BrClO2/c1-9-6-15-11(7-14(9)18)16(19)12(8-20-15)10-4-2-3-5-13(10)17/h2-8H,1H3
InChIKey KOUCLASGGOOWBJ-UHFFFAOYSA-N
Instrument Name GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.0c02294
Molecular Weight 349.611 g/mol
SMILES c1(Br)c(cccc1)C1=COc2c(C1=O)cc(c(c2)C)Cl
SPLASH splash10-014i-1190000000-b0c072ce29e82f905689
Source of Spectrum JOC-86-4909-5y
Thin-Layer Chromatography Rf = 0.65 (Hex/EtAc, 5:1)
Wiley ID 1867951