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Benzenepropanoic acid, 2-bromo-3,5-dimethoxy-
SpectraBase Compound ID 5QaQ4uuH6F0
InChI InChI=1S/C11H13BrO4/c1-15-8-5-7(3-4-10(13)14)11(12)9(6-8)16-2/h5-6H,3-4H2,1-2H3,(H,13,14)
InChIKey MMAVBXCYTVNGFY-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 I0Rbm3nwWYg
Name Benzenepropanoic acid, 2-bromo-3,5-dimethoxy-
Alternate Name(s) 3-(2-Bromo-3,5-dimethoxyphenyl)propanoic acid
CAS Registry Number 105705-37-1
Comments Less than 3 mono-isotopic peaks
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Formula C11H13BrO4
InChI InChI=1S/C11H13BrO4/c1-15-8-5-7(3-4-10(13)14)11(12)9(6-8)16-2/h5-6H,3-4H2,1-2H3,(H,13,14)
InChIKey MMAVBXCYTVNGFY-UHFFFAOYSA-N
Molecular Weight 289.125 g/mol
SMILES OC(CCc1c(c(cc(c1)OC)OC)Br)=O
SPLASH splash10-014i-9030000000-380e5550957e17953327
Source of Spectrum B-39-794-9
Wiley ID 1291246