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1-(2-Bromo-3,4,5-trimethoxyphenyl)ethan-1-one
SpectraBase Compound ID ALk2ylh3Ywo
InChI InChI=1S/C11H13BrO4/c1-6(13)7-5-8(14-2)10(15-3)11(16-4)9(7)12/h5H,1-4H3
InChIKey BNHOTOXEFJYCFG-UHFFFAOYSA-N
Mol Weight 289.12 g/mol
Molecular Formula C11H13BrO4
Exact Mass 287.999722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4uTZYjYhXI8
Name 1-(2-Bromo-3,4,5-trimethoxyphenyl)ethan-1-one
Appearance Colorless crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13BrO4
InChI InChI=1S/C11H13BrO4/c1-6(13)7-5-8(14-2)10(15-3)11(16-4)9(7)12/h5H,1-4H3
InChIKey BNHOTOXEFJYCFG-UHFFFAOYSA-N
Instrument Name Finnigan MAT/INCOS 50
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.6b00173
Molecular Weight 289.125 g/mol
SMILES c1(Br)c(cc(c(c1OC)OC)OC)C(C)=O
SPLASH splash10-0006-8090000000-ef29150cec21a88bf638
Source of Spectrum G4-79-1433-5d
Wiley ID 1849337