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Benzoic acid, 2-acetoxy-6-bromo-3-ethoxy-, methyl ester
SpectraBase Compound ID LcNfnvjH56G
InChI InChI=1S/C12H13BrO5/c1-4-17-9-6-5-8(13)10(12(15)16-3)11(9)18-7(2)14/h5-6H,4H2,1-3H3
InChIKey KVFBSVCGFZHUQD-UHFFFAOYSA-N
Mol Weight 317.14 g/mol
Molecular Formula C12H13BrO5
Exact Mass 315.994637 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EwOcNZNaQY5
Name Benzoic acid, 2-acetoxy-6-bromo-3-ethoxy-, methyl ester
Alternate Name(s) 2-Acetoxy-6-bromo-3-ethoxy-benzoic acid methyl ester 2-Acetyloxy-6-bromo-3-ethoxybenzoic acid methyl ester Methyl 2-acetoxy-6-bromo-3-ethoxy-benzoate Methyl 2-acetyloxy-6-bromanyl-3-ethoxy-benzoate Methyl 2-acetyloxy-6-bromo-3-ethoxybenzoate
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Formula C12H13BrO5
InChI InChI=1S/C12H13BrO5/c1-4-17-9-6-5-8(13)10(12(15)16-3)11(9)18-7(2)14/h5-6H,4H2,1-3H3
InChIKey KVFBSVCGFZHUQD-UHFFFAOYSA-N
Molecular Weight 317.135 g/mol
SMILES c1(c(OC(=O)C)c(OCC)ccc1Br)C(=O)OC
SPLASH splash10-0006-2290000000-6746aebf927a30ee394e
Source of Spectrum AD-0-2532-0
Wiley ID 1429577