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Ethyl-D,L-2-bromopropionate
SpectraBase Compound ID 8JZFPxUEhwW
InChI InChI=1S/C5H9BrO2/c1-3-8-5(7)4(2)6/h4H,3H2,1-2H3
InChIKey ARFLASKVLJTEJD-UHFFFAOYSA-N
Mol Weight 181.03 g/mol
Molecular Formula C5H9BrO2
Exact Mass 179.978593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1kAeBxDYjVl
Name Propanoic acid, 2-bromo-, ethyl ester
CAS Registry Number 535-11-5
Comments Note: The molecular formula of the structure shown is C5H9BrO2 - which differs from the formula reported for the mass spectrum (C5H8DBrO2)
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Formula C5H8DBrO2
InChI InChI=1S/C5H9BrO2/c1-3-8-5(7)4(2)6/h4H,3H2,1-2H3
InChIKey ARFLASKVLJTEJD-UHFFFAOYSA-N
Molecular Weight 181.029 g/mol
SMILES CC(Br)C(=O)OCC
SPLASH splash10-056r-9600000000-89f52c609ab5f88a56b2
Synonyms .alpha.-Bromopropionic acid ethyl ester 2-Bromopropanoic acid, ethyl ester 2-Bromopropionic acid ethyl ester Ethyl (1)-2-bromopropionate Ethyl .alpha.-bromopropanoate Ethyl 2-bromopropanoate Ethyl .alpha.-bromopropionate Ethyl 2-bromanylpropanoate Ethyl dl-2-bromopropionate Ethyl-2-bromopropionate Propionic acid, 2-bromo-, ethyl ester AI3-28576 BRN 0773920 CCRIS 5674 EINECS 208-609-5 EINECS 255-601-2 NSC 6753
Wiley ID 1483915