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methyl 2-allyl-4-bromo-3,6-dimethoxy-benzoate
SpectraBase Compound ID FXeyFQHNpNU
InChI InChI=1S/C12H13BrO4/c1-4-5-7-10(12(15)17-3)9(16-2)6-8(13)11(7)14/h4,6,14H,1,5H2,2-3H3
InChIKey BDPIBBVLTWMMSN-UHFFFAOYSA-N
Mol Weight 301.14 g/mol
Molecular Formula C12H13BrO4
Exact Mass 299.999722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ArGwzZUfC0r
Name methyl 2-allyl-4-bromo-3,6-dimethoxy-benzoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13BrO4
InChI InChI=1S/C12H13BrO4/c1-4-5-7-10(12(15)17-3)9(16-2)6-8(13)11(7)14/h4,6,14H,1,5H2,2-3H3
InChIKey BDPIBBVLTWMMSN-UHFFFAOYSA-N
Ionization Type EI
SMILES Oc1c(c(c(cc1Br)OC)C(=O)OC)CC=C
SPLASH splash10-0uxr-0079000000-795481b1c4a00430d271
Source of Spectrum CN108558899A
Thin-Layer Chromatography Rf = 0.68 (ethyl acetate/petroleum ether, 20%)
Wiley ID 1872437