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Diethyl 2-(2-Bromo-4,5-dimethoxybenzyl)malonate
SpectraBase Compound ID 3WPyP14g1my
InChI InChI=1S/C16H21BrO6/c1-5-22-15(18)11(16(19)23-6-2)7-10-8-13(20-3)14(21-4)9-12(10)17/h8-9,11H,5-7H2,1-4H3
InChIKey YQGOFVCXUTUXEX-UHFFFAOYSA-N
Mol Weight 389.24 g/mol
Molecular Formula C16H21BrO6
Exact Mass 388.052151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JDBy35rfcNC
Name Diethyl 2-(2-Bromo-4,5-dimethoxybenzyl)malonate
Appearance White solid
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Formula C16H21BrO6
InChI InChI=1S/C16H21BrO6/c1-5-22-15(18)11(16(19)23-6-2)7-10-8-13(20-3)14(21-4)9-12(10)17/h8-9,11H,5-7H2,1-4H3
InChIKey YQGOFVCXUTUXEX-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/asia.201901595
Molecular Weight 389.242 g/mol
Reported Formula C16H21BrO6
SMILES c1(cc(c(cc1OC)Br)CC(C(=O)OCC)C(=O)OCC)OC
SPLASH splash10-0ar9-1592000000-c529dfaef666b3239f46
Source of Spectrum CAJ-15-SM2-7
Thin-Layer Chromatography Rf = 0.46 (Hexane/AcOEt, 1:1)
Wiley ID 1839710