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Methyl 3-bromo-4-methoxybenzoate
SpectraBase Compound ID 2ZP6JXUD8yP
InChI InChI=1S/C9H9BrO3/c1-12-8-4-3-6(5-7(8)10)9(11)13-2/h3-5H,1-2H3
InChIKey ZREVPFANJBZHEU-UHFFFAOYSA-N
Mol Weight 245.07 g/mol
Molecular Formula C9H9BrO3
Exact Mass 243.973507 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJV6kg29260
Name Methyl 3-bromo-4-methoxybenzoate
Alternate Name(s) 3-bromo-4-methoxy-benzoic acid methyl ester Benzoic acid, 3-bromo-4-methoxy-, methyl ester methyl 3-bromanyl-4-methoxy-benzoate methyl 3-bromo-4-methoxy-benzoate 3-bromo-4-methoxybenzoic acid methyl ester
CAS Registry Number 35450-37-4
Comments Less than 3 mono-isotopic peaks
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Formula C9H9BrO3
InChI InChI=1S/C9H9BrO3/c1-12-8-4-3-6(5-7(8)10)9(11)13-2/h3-5H,1-2H3
InChIKey ZREVPFANJBZHEU-UHFFFAOYSA-N
Molecular Weight 245.072 g/mol
SMILES c1(c(OC)ccc(C(OC)=O)c1)Br
SPLASH splash10-03xv-0090000000-415e5aba1a48c009c380
Source of Spectrum J-62-4506-0
Wiley ID 1246466