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Methyl (3R)-3-(p-bromobenzoyloxy)butyrate
SpectraBase Compound ID Bbs1P2YP3K7
InChI InChI=1S/C12H13BrO4/c1-8(7-11(14)16-2)17-12(15)9-3-5-10(13)6-4-9/h3-6,8H,7H2,1-2H3/t8-/m1/s1
InChIKey YQKVXDZGYPJEAG-MRVPVSSYSA-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 8JHwJ5888Cv
Name Methyl (3R)-3-(p-bromobenzoyloxy)butyrate
Alternate Name(s) 4-Bromobenzoic acid[(1R)-3-keto-3-methoxy-1-methyl-propyl]ester 4-Bromobenzoic acid[(2R)-4-methoxy-4-oxobutan-2-yl]ester [(1R)-3-methoxy-1-methyl-3-oxo-propyl]4-bromobenzoate [(2R)-4-methoxy-4-oxidanylidene-butan-2-yl]4-bromanylbenzoate [(2R)-4-methoxy-4-oxobutan-2-yl]4-bromobenzoate 4-Bromobenzoic acid [(2R)-4-methoxy-4-oxobutan-2-yl] ester [(2R)-4-methoxy-4-oxobutan-2-yl] 4-bromobenzoate [(1R)-3-methoxy-1-methyl-3-oxo-propyl] 4-bromobenzoate [(2R)-4-methoxy-4-oxidanylidene-butan-2-yl] 4-bromanylbenzoate
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Formula C12H13BrO4
InChI InChI=1S/C12H13BrO4/c1-8(7-11(14)16-2)17-12(15)9-3-5-10(13)6-4-9/h3-6,8H,7H2,1-2H3/t8-/m1/s1
InChIKey YQKVXDZGYPJEAG-MRVPVSSYSA-N
Molecular Weight 301.136 g/mol
SMILES C(C[C@@](C)(OC(c1ccc(cc1)Br)=O)[H])(=O)OC
SPLASH splash10-0ue9-0963000000-7fc5ecbdef1f2a2f6992
Source of Spectrum K-2001-3051-10
Wiley ID 1580034